UPADACITINIB

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H19F3N6O
Molecular Weight	380.3676
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of UPADACITINIB

Structure Search

SMILES

CC[C@@H]1CN(C[C@@H]1C2=CN=C3C=NC4=C(C=CN4)N23)C(=O)NCC(F)(F)F

InChI

InChIKey=WYQFJHHDOKWSHR-MNOVXSKESA-N

InChI=1S/C17H19F3N6O/c1-2-10-7-25(16(27)24-9-17(18,19)20)8-11(10)13-5-22-14-6-23-15-12(26(13)14)3-4-21-15/h3-6,10-11,21H,2,7-9H2,1H3,(H,24,27)/t10-,11+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

UPADACITINIB

Official Name

English

ABBV-599 COMPONENT UPADACITINIB

Common Name

English

UPADACITINIB [ORANGE BOOK]

Common Name

English

(3S,4R)-3-ETHYL-4-(3H-IMIDAZO(1,2-A)PYRROLO(2,3-E)PYRAZIN- 8-YL)-N-(2,2,2-TRIFLUOROETHYL)PYRROLIDINE-1-CARBOXAMIDE TYROSINE KINASE INHIBITOR

Common Name

English

UPADACITINIB [MI]

Common Name

English

UPADACITINIB [USAN]

Common Name

English

(3S,4R)-3-ETHYL-4-(3H-IMIDAZO(1,2-A)PYRROLO(2,3-E)PYRAZIN-8-YL)-N-(2,2,2-TRIFLUOROETHYL)-1-PYRROLIDINECARBOXAMIDE

Systematic Name

English

ABT-494

Code

English

UPADACITINIB COMPONENT OF ABBV-599

Common Name

English

Upadacitinib [WHO-DD]

Common Name

English

1-PYRROLIDINECARBOXAMIDE, 3-ETHYL-4-(3H-IMIDAZO(1,2-A)PYRROLO(2,3-E)PYRAZIN-8-YL)-N-(2,2,2-TRIFLUOROETHYL)-, (3S,4R)-

Systematic Name

English

UPADACITINIB ANHYDROUS

Common Name

English

upadacitinib [INN]

Common Name

English

REL-(-)-(3S,4R)-3-ETHYL-4-(3H-IMIDAZO(1,2-A)PYRROLO(2,3-E)PYRAZIN-8-YL)-N-(2,2,2-TRIFLUOROETHYL)PYRROLIDINE-1-CARBOXAMIDE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1967

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

FDA ORPHAN DRUG

522916

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

FDA ORPHAN DRUG

524116

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

FDA ORPHAN DRUG

575517

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

Code System Code Type Description

USAN

CD-19

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

RXCUI

2196092

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

INN

10209

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

WIKIPEDIA

Upadacitinib

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

SMS_ID

100000173002

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

DRUG CENTRAL

5346

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

FDA UNII

4RA0KN46E0

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

PUBCHEM

58557659

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

DRUG BANK

DB15091

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

DAILYMED

4RA0KN46E0

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

NCI_THESAURUS

C152802

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

MERCK INDEX

m12178

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

CAS

1310726-60-3

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

LACTMED

Upadacitinib

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

EPA CompTox

DTXSID901027919

Created by admin on Sat Dec 16 08:54:19 UTC 2023 , Edited by admin on Sat Dec 16 08:54:19 UTC 2023

PRIMARY

ACTIVE MOIETY


					4RA0KN46E0

METABOLITE (PARENT)


					7AM4F4K5VA

(3S,4R)-3-ETHYL-4-(3H-IMIDAZO(1,2-A)PYRROLO(2,3-E)PYRAZIN-8-YL)-N-(2,2,2-TRIFLUORO-1-HYDROXYETHYL)PYRROLIDINE-1-CARBOXAMIDE

METABOLITE INACTIVE (PARENT)


					FVX82Q3ZNW

5-((3R,4S)-4-ETHYL-1-(2,2,2-TRIFLUOROETHYLCARBAMOYL)PYRROLIDIN-3-YL)-1H-IMIDAZOLE-2-CARBOXAMIDE

SALT/SOLVATE (PARENT)


					328W323FLH

UPADACITINIB TARTRATE ANHYDROUS

SALT/SOLVATE (PARENT)


					7KCW9IQM02

UPADACITINIB TARTRATE

SALT/SOLVATE (PARENT)


					NEW4DV02U5

UPADACITINIB HEMIHYDRATE