U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C18H22N4O2
Molecular Weight 326.3929
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PEFICITINIB

SMILES

NC(=O)C1=CN=C2NC=CC2=C1N[C@H]3[C@H]4CC5C[C@@H]3C[C@@](O)(C5)C4

InChI

InChIKey=DREIJXJRTLTGJC-RRBRBRQDSA-N
InChI=1S/C18H22N4O2/c19-16(23)13-8-21-17-12(1-2-20-17)15(13)22-14-10-3-9-4-11(14)7-18(24,5-9)6-10/h1-2,8-11,14,24H,3-7H2,(H2,19,23)(H2,20,21,22)/t9?,10-,11+,14-,18+

HIDE SMILES / InChI

Molecular Formula C18H22N4O2
Molecular Weight 326.3929
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 3 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:28:11 UTC 2023
Edited
by admin
on Sat Dec 16 01:28:11 UTC 2023
Record UNII
HPH1166CKX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PEFICITINIB
INN   USAN   WHO-DD  
USAN   INN  
Official Name English
peficitinib [INN]
Common Name English
JNJ-54781532
Code English
PEFICITINIB [USAN]
Common Name English
4-((TRANS-5-HYDROXYADAMANTAN-2-YL)AMINO)-1H-PYRROLO(2,3-B)PYRIDINE-5-CARBOXAMIDE
Systematic Name English
ASP015K
Code English
ASP-015K
Code English
Peficitinib [WHO-DD]
Common Name English
PEFICITINIB HYDROBROMIDE [JAN]
Common Name English
4-((ANTI-5-HYDROXYADAMANTAN-2-YL)AMINO)-1H-PYRROLO(2,3-B)PYRIDINE-5-CARBOXAMIDE
Systematic Name English
Code System Code Type Description
CAS
944118-01-8
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
USAN
AB-46
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
NCI_THESAURUS
C170291
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
FDA UNII
HPH1166CKX
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
SMS_ID
100000170786
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
ChEMBL
CHEMBL3137308
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
INN
9910
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
EPA CompTox
DTXSID801319101
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
EVMPD
SUB184949
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
DRUG BANK
DB11708
Created by admin on Sat Dec 16 01:28:11 UTC 2023 , Edited by admin on Sat Dec 16 01:28:11 UTC 2023
PRIMARY
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