2-(1H-Pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid [(R)-1-(4-cyano-piperidine-1-carbonyl)-2,2-dimethyl-propyl]-amide

HCID 53386202
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Basic information

Standard SMILES
CC(C)(C)[C@@H](NC(=O)c1c[nH]c2ncc(-c3cn[nH]c3)nc12)C(=O)N1CCC(C#N)CC1
InChIKey
RXEDWPMTRJMIJB-SFHVURJKSA-N
Molecular formula
C22H26N8O2
Average molar mass
434.5 g/mol
Monoisotopic mass
434.2178721

Names & identifiers

Preferred name
2-(1H-Pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid [(R)-1-(4-cyano-piperidine-1-carbonyl)-2,2-dimethyl-propyl]-amide
IUPAC
N-[(2R)-1-(4-cyanopiperidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

Names & synonyms

SCHEMBL2379670RXEDWPMTRJMIJB-SFHVURJKSA-N2-(1H-Pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid [(R)-1-(4-cyano-piperidine-1-carbonyl)-2,2-dimethyl-propyl]-amide

Database identifiers

PubChem CID
53386202

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
143 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
32

Related reactions

1 records
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Compound notes

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