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

HCID 53386153
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Basic information

Standard SMILES
CC(C)(C)[C@@H](NC(=O)c1c[nH]c2ncc(-c3cccc(N4CCCC4)c3)nc12)C(=O)N1CCC(C#N)CC1
InChIKey
OHKFWKLZSGVJRJ-VWLOTQADSA-N
Molecular formula
C29H35N7O2
Average molar mass
513.6 g/mol
Monoisotopic mass
513.28522338

Names & identifiers

Preferred name
2-(3-Pyrrolidin-1-yl-phenyl)-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-(3-pyrrolidin-1-ylphenyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

Names & synonyms

SCHEMBL2379593OHKFWKLZSGVJRJ-VWLOTQADSA-N2-(3-Pyrrolidin-1-yl-phenyl)-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
53386153

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
118 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
38

Related reactions

1 records
New reaction record

Compound notes

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