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Details

Stereochemistry ACHIRAL
Molecular Formula C21H32N6O3.ClH.H2O
Molecular Weight 470.993
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALFENTANIL HYDROCHLORIDE

SMILES

O.Cl.CCN1N=NN(CCN2CCC(COC)(CC2)N(C(=O)CC)C3=CC=CC=C3)C1=O

InChI

InChIKey=YYESXRRYBUERKF-UHFFFAOYSA-N
InChI=1S/C21H32N6O3.ClH.H2O/c1-4-19(28)27(18-9-7-6-8-10-18)21(17-30-3)11-13-24(14-12-21)15-16-26-20(29)25(5-2)22-23-26;;/h6-10H,4-5,11-17H2,1-3H3;1H;1H2

HIDE SMILES / InChI
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula C21H32N6O3
Molecular Weight 416.5172
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:23:41 UTC 2023
Edited
by admin
on Fri Dec 15 15:23:41 UTC 2023
Record UNII
11S92G0TIW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALFENTANIL HYDROCHLORIDE
EP   MART.   ORANGE BOOK   USAN   USP   VANDF  
USAN  
Official Name English
ALFENTANIL HYDROCHLORIDE [ORANGE BOOK]
Common Name English
R 39209
Code English
ALFENTANIL HYDROCHLORIDE [MART.]
Common Name English
ALFENTANIL HYDROCHLORIDE [VANDF]
Common Name English
R-39209
Code English
PROPANAMIDE, N-(1-(2-(4-ETHYL-4,5-DIHYDRO-5-OXO-1H-TETRAZOL-1-YL)ETHYL)-4-(METHOXYMETHYL)-4-PIPERIDINYL)-N-PHENYL-, HYDROCHLORIDE, HYDRATE (1:1:1)
Systematic Name English
ALFENTANIL HYDROCHLORIDE MONOHYDRATE
MI  
Common Name English
ALFENTANIL HYDROCHLORIDE MONOHYDRATE [MI]
Common Name English
ALFENTANIL HYDROCHLORIDE [USAN]
Common Name English
ALFENTANIL HYDROCHLORIDE [USP MONOGRAPH]
Common Name English
ALFENTANIL HYDROCHLORIDE [EP IMPURITY]
Common Name English
R-39,209
Code English
N-[1-[2-(4-Ethyl-5-oxo-2-tetrazolin-1-yl)-ethyl]-4-(methoxymethyl)-4-piperidyl]propionanilide monohydrochloride monohydrate
Systematic Name English
PROPANAMIDE, N-(1-(2-(4-ETHYL-4,5-DIHYDRO-5-OXO-1H-TETRAZOL-1-YL)ETHYL)-4-(METHOXYMETHYL)-4-PIPERIDINYL)-N-PHENYL, MONOHYDROCHLORIDE, MONOHYDRATE
Common Name English
R 39,209
Code English
ALFENTANIL HYDROCHLORIDE [USP IMPURITY]
Common Name English
ALFENTA
Brand Name English
ALFENTANIL HYDROCHLORIDE [USP-RS]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C1506
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
NCI_THESAURUS C67413
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
Code System Code Type Description
CAS
70879-28-6
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
EPA CompTox
DTXSID50221107
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
PUBCHEM
64762
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
ChEMBL
CHEMBL634
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
NCI_THESAURUS
C220
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
SMS_ID
300000038460
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
RXCUI
203203
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY RxNorm
RS_ITEM_NUM
1012906
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
DRUG BANK
DBSALT001202
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
FDA UNII
11S92G0TIW
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
EVMPD
SUB00339MIG
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
DAILYMED
11S92G0TIW
Created by admin on Fri Dec 15 15:23:41 UTC 2023 , Edited by admin on Fri Dec 15 15:23:41 UTC 2023
PRIMARY
Related Record Type Details
Structure of ALFENTANIL HYDROCHLORIDE ANHYDROUS
ANHYDROUS->SOLVATE
Structure of ALFENTANIL
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of NORALFENTANIL
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of N-[1-[2-(4-Ethyl-5-oxo-4,5-dihydro-1H-tetrazol-1-yl)ethyl]-4-(methoxymethyl)piperidin-4-yl]-N-phenylbutanamide
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of N-(1-(2-(4-ETHYL-5-OXO-4,5-DIHYDRO-1H-TETRAZOL-1-YL)ETHYL)-4-((PROPANOYLOXY)METHYL)PIPERIDIN-4-YL)-N-PHENYLPROPANAMIDE
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of N-(1-(2-(4-ETHYL-5-OXO-4,5-DIHYDRO-1H-TETRAZOL-1-YL)ETHYL)-4-(METHOXYMETHYL)PIPERIDIN-4-YL)-N-PHENYLACETAMIDE
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of (1r,4r)-1-[2-(4-ethyl-5-oxo-4,5-dihydro-1H-tetrazol-1-yl)ethyl]-4-(methoxymethyl)-4-(N-phenylpropanamido)piperidine 1-oxide
IMPURITY -> PARENT
ALFENTANIL HYDROCHLORIDE IS ALFENTANIL HYDROCHLORIDE HYDRATE AS PER EP MONOGRAPH
Structure of N-(1-(2-HYDROXYETHYL)-4-(METHOXYMETHYL)PIPERIDIN-4-YL)-N-PHENYLPROPANAMIDE
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of (1s,4s)-1-[2-(4-ethyl-5-oxo-4,5-dihydro-1H-tetrazol-1-yl)ethyl]-4-(methoxymethyl)-4-(N-phenylpropanamido)piperidine 1-oxide
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Structure of 1-ETHYL-1,4-DIHYDRO-4-(2-(4-(METHOXYMETHYL)-4-(PHENYLAMINO)-1-PIPERIDINYL)ETHYL)-5H-TETRAZOL-5-ONE
IMPURITY -> PARENT
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Related Record Type Details
Structure of ALFENTANIL
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