API reference

Upadacitinib

CAS number
1310726-60-3
Molecular formula
C17H19F3N6O
Molecular weight
380.4 g/mol
Upadacitinib — 2D structure
2D structure (PubChem)

About this molecule

Upadacitinib is an oral selective inhibitor of Janus associated kinase 1 (JAK-1) that is used in the therapy of moderate-to-severe rheumatoid arthritis. Upadacitinib has been associated with a low rate of serum enzyme elevations during therapy, but has not been linked to cases of clinically apparent acute liver injury although it may pose a risk for reactivation of hepatitis B in susceptible patients.

Source: LiverTox, via PubChem.

Identifiers

IUPAC name
(3S,4R)-3-ethyl-4-(1,5,7,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl)-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
InChIKey
WYQFJHHDOKWSHR-MNOVXSKESA-N
SMILES
CC[C@@H]1CN(C[C@@H]1C2=CN=C3N2C4=C(NC=C4)N=C3)C(=O)NCC(F)(F)F
PubChem CID
58557659

Also known as

Upadacitinib · ABT-494 · Upadacitinib anhydrous · upadacitinibum · L04AA44 · Rinvoq · ABT 494 · ABBV-599 COMPONENT UPADACITINIB

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