4-Methyl-3-(methyl-7H-pyrrolo(2,3-d)pyrimidin-4-ylamino)-beta-oxo-1-piperidinepropanenitrile

cas: 344418-92-4 — see every product listed under this CAS number, including other names

4-Methyl-3-(methyl-7H-pyrrolo(2,3-d)pyrimidin-4-ylamino)-beta-oxo-1-piperidinepropanenitrile (CAS 344418-92-4) is a chemical reagent available from Chemat. Available pack sizes: 250mg. Offered by: TRC.

• 2D
• 3D

3-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile (CAS 344418-92-4) is a chemical compound with the molecular formula C16H20N6O and a molecular weight of 312.37 g/mol. IUPAC name: 3-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile. InChIKey: UJLAWZDWDVHWOW-UHFFFAOYSA-N.

Identity

Molecular formula	C16H20N6O
Molecular weight	312.37 g/mol
IUPAC name	3-[4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile
InChIKey	UJLAWZDWDVHWOW-UHFFFAOYSA-N
SMILES	CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N

Computed by PubChem (NCBI)

Synonyms: racemic-Tasocitinib, rac-Tofacitinib, racemic-tofacitinib, Kinome_3438, s2789, Tofacitinib Impurity 34 (Mixture of Diastereomers)

Related forms of this compound

3-[(3S,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C₁₆H₂₀N₆O

3-[(3R,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C₁₆H₂₀N₆O

3-[(3S,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C₁₆H₂₀N₆O

3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C₁₆H₂₀N₆O

3-[(3R,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C₁₆H₂₀N₆O

3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C₁₆H₂₀N₆O

Isomers (same molecular formula)

2-cyano-N-methyl-N-[(3R,4R)-4-methyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-3-yl]acetamide C₁₆H₂₀N₆O

3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-2-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C₁₆H₂₀N₆O