Basic information
- Standard SMILES
Cn1cc(C(=O)c2cncc(NC(=O)C3(c4ccccc4)CC3)c2)c2cncnc21- InChIKey
WDPUKEGOAFSKLV-UHFFFAOYSA-N- Molecular formula
- C23H19N5O2
- Average molar mass
- 397.4 g/mol
Names & identifiers
- Preferred name
- N-{5-[(7-methyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)carbonyl]pyridin-3-yl}-1-phenylcyclopropanecarboxamide
- IUPAC
- N-[5-(7-methylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]-1-phenylcyclopropane-1-carboxamide
Names & synonyms
CHEMBL3666327SCHEMBL12985021WDPUKEGOAFSKLV-UHFFFAOYSA-NBDBM134860US8846698, 336N-{5-[(7-methyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)carbonyl]pyridin-3-yl}-1-phenylcyclopropanecarboxamide
Database identifiers
- PubChem CID
- 70817501
- ChEMBL
CHEMBL3666327
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 660
Related reactions
1 records
Compound notes
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