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Details

Stereochemistry RACEMIC
Molecular Formula C23H27FN4O3
Molecular Weight 426.4839
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PALIPERIDONE

SMILES

CC1=C(CCN2CCC(CC2)C3=NOC4=C3C=CC(F)=C4)C(=O)N5CCCC(O)C5=N1

InChI

InChIKey=PMXMIIMHBWHSKN-UHFFFAOYSA-N
InChI=1S/C23H27FN4O3/c1-14-17(23(30)28-9-2-3-19(29)22(28)25-14)8-12-27-10-6-15(7-11-27)21-18-5-4-16(24)13-20(18)31-26-21/h4-5,13,15,19,29H,2-3,6-12H2,1H3

HIDE SMILES / InChI
Molecular Formula C23H27FN4O3
Molecular Weight 426.4839
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:17:28 UTC 2023
Edited
by admin
on Fri Dec 15 16:17:28 UTC 2023
Record UNII
838F01T721
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PALIPERIDONE
EMA EPAR   INN   JAN   MART.   MI   ORANGE BOOK   USAN   USP-RS   VANDF   WHO-DD  
INN   USAN  
Official Name English
PALIPERIDONE [USAN]
Common Name English
4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE, 3-(2-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)ETHYL)-6,7,8,9-TETRAHYDRO-9-HYDROXY-2-METHYL-
Systematic Name English
3-(2-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)ETHYL)-6,7,8,9-TETRAHYDRO-9-HYDROXY-2-METHYL-4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE
Systematic Name English
PALIPERIDONE [USP MONOGRAPH]
Common Name English
PALIPERIDONE [MART.]
Common Name English
PALIPERIDONE [EMA EPAR]
Common Name English
RISPERIDONE IMPURITY C [EP IMPURITY]
Common Name English
9-HYDROXYRISPERIDONE
Common Name English
RO76477
Code English
paliperidone [INN]
Common Name English
PALIPERIDONE [VANDF]
Common Name English
(9RS)-3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)piperidin-1-yl]]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one
Common Name English
NSC-759623
Code English
PALIPERIDONE [ORANGE BOOK]
Common Name English
RISPERIDONE IMPURITY, 9-HYDROXYRISPERIDONE- [USP IMPURITY]
Common Name English
PALIPERIDONE [USP-RS]
Common Name English
PALIPERIDONE [MI]
Common Name English
Paliperidone [WHO-DD]
Common Name English
R-76477
Code English
RO-76477
Code English
PALIPERIDONE [JAN]
Common Name English
INVEGA
Brand Name English
Classification Tree Code System Code
WHO-ATC N05AX13
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
WHO-VATC QN05AX13
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
LIVERTOX NBK548506
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
NDF-RT N0000175430
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
EMA ASSESSMENT REPORTS INVEGA (AUTHORIZED: PSYCHOTIC DISORDERS)
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
EMA ASSESSMENT REPORTS INVEGA (AUTHORIZED: SCHIZOPHRENIA)
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
NCI_THESAURUS C66883
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
Code System Code Type Description
DRUG CENTRAL
4137
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
LACTMED
Paliperidone
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
ChEMBL
CHEMBL1621
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
EPA CompTox
DTXSID7049059
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
RS_ITEM_NUM
1491809
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
WIKIPEDIA
PALIPERIDONE
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
DRUG BANK
DB01267
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
USAN
QQ-13
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
INN
7977
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
DAILYMED
838F01T721
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
CAS
144598-75-4
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
SMS_ID
100000092109
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
IUPHAR
7258
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
PUBCHEM
115237
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
RXCUI
679314
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY RxNorm
NCI_THESAURUS
C66293
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
FDA UNII
838F01T721
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
EVMPD
SUB23268
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
MERCK INDEX
m8357
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY Merck Index
CHEBI
82978
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
NSC
759623
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
HSDB
8148
Created by admin on Fri Dec 15 16:17:28 UTC 2023 , Edited by admin on Fri Dec 15 16:17:28 UTC 2023
PRIMARY
Related Record Type Details
MUSCARINIC ACETYLCHOLINE RECEPTOR M3
OFF-TARGET->NON-INHIBITOR
NON-INHIBITOR
Ki
CYTOCHROME P450 2D6
METABOLIC ENZYME -> SUBSTRATE
HISTAMINE H1 RECEPTOR
TARGET -> INHIBITOR
INHIBITOR
Ki
ALPHA-1A ADRENERGIC RECEPTOR
TARGET -> INHIBITOR
INHIBITOR
Ki
MUSCARINIC ACETYLCHOLINE RECEPTOR M5
OFF TARGET->NON-INHIBITOR
NON-INHIBITOR
Ki
D(4) DOPAMINE RECEPTOR
TARGET -> INHIBITOR
INHIBITOR
Ki
ALPHA-2C ADRENERGIC RECEPTOR
TARGET -> INHIBITOR
INHIBITOR
Ki
Structure of PALIPERIDONE
EXCRETED UNCHANGED
AMOUNT EXCRETED
URINE
5-HYDROXYTRYPTAMINE RECEPTOR 1D
TARGET -> INHIBITOR
INHIBITOR
Ki
HISTAMINE H2 RECEPTOR
TARGET->WEAK INHIBITOR
INHIBITOR
Ki
5-HYDROXYTRYPTAMINE RECEPTOR 2A
TARGET -> INHIBITOR
INHIBITOR
Ki
5-HYDROXYTRYPTAMINE RECEPTOR 1E
TARGET -> INHIBITOR
INHIBITOR
Ki
MUSCARINIC ACETYLCHOLINE RECEPTOR M4
OFF TARGET->NON-INHIBITOR
NON-INHIBITOR
Ki
D(2) DOPAMINE RECEPTOR
TARGET -> INHIBITOR
INHIBITOR
Ki
5-HYDROXYTRYPTAMINE RECEPTOR 5A
TARGET -> INHIBITOR
INHIBITOR
Ki
MULTIDRUG RESISTANCE PROTEIN 1
TRANSPORTER -> SUBSTRATE
TRANSPORTER
IC50
MUSCARINIC ACETYLCHOLINE RECEPTOR M2
OFF TARGET->NON-INHIBITOR
NON-INHIBITOR
Ki
PLASMA PROTEIN FRACTION (HUMAN)
BINDER->LIGAND
5-HYDROXYTRYPTAMINE RECEPTOR 4
TARGET -> INHIBITOR
INHIBITOR
Ki
ALPHA-2B ADRENERGIC RECEPTOR
TARGET -> INHIBITOR
INHIBITOR
Ki
5-HYDROXYTRYPTAMINE RECEPTOR 1A
TARGET -> INHIBITOR
INHIBITOR
Ki
D(1B) DOPAMINE RECEPTOR
TARGET -> INHIBITOR
INHIBITOR
Ki
MUSCARINIC ACETYLCHOLINE RECEPTOR M1
OFF TARGET->NON-INHIBITOR
NON-INHIBITOR
Ki
5-HYDROXYTRYPTAMINE RECEPTOR 7
TARGET -> INHIBITOR
INHIBITOR
Ki
5-HYDROXYTRYPTAMINE RECEPTOR 6
TARGET -> INHIBITOR
INHIBITOR
Ki
CYTOCHROME P450 3A4
METABOLIC ENZYME -> SUBSTRATE
5-HYDROXYTRYPTAMINE RECEPTOR 1B
TARGET -> INHIBITOR
INHIBITOR
Ki
5-HYDROXYTRYPTAMINE RECEPTOR 2C
TARGET -> INHIBITOR
INHIBITOR
Ki
D(3) DOPAMINE RECEPTOR
TARGET -> INHIBITOR
INHIBITOR
Ki
Related Record Type Details
Structure of R-93725
METABOLITE -> PARENT
Trace in feces
URINE
Structure of R-84852
METABOLITE -> PARENT
FECAL
Structure of Paliperidone ketone
METABOLITE -> PARENT
URINE
Structure of RISPERIDONE
PARENT -> METABOLITE ACTIVE
MAJOR
PLASMA
Related Record Type Details
Structure of 3-(2-CHLOROETHYL)-2-METHYL-9-HYDROXY-6,7,8,9-TETRAHYDRO-4H-PYRIDO (1,2-A) PYRIMIDIN-4-ONE
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of RISPERIDONE
PARENT -> IMPURITY
not more than the area of the principal peak in the chromatogram obtained with reference solution (b)
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of 6,7,8,9-TETRAHYDRO-9-HYDROXY-3-(2-HYDROXYETHYL)-2-METHYL-4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE
IMPURITY -> PARENT
Structure of R-84852
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of 3-ETHYL-6,7,8,9-TETRAHYDRO-9-HYDROXY-2-METHYL-4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE
IMPURITY -> PARENT
Structure of R-56109
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Structure of Paliperidone ketone
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
Related Record Type Details
Structure of PALIPERIDONE
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
ORAL BIOAVAILABILITY PHARMACOKINETIC
Biological Half-life PHARMACOKINETIC
Volume of Distribution PHARMACOKINETIC
Tmax PHARMACOKINETIC
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
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