Basic information
- Standard SMILES
CC(C)CNC(=O)C(C)(C)c1ccc(-c2cncc(C#N)c2)cc1- InChIKey
NXRMHQDISNPTQA-UHFFFAOYSA-N- Molecular formula
- C20H23N3O
- Average molar mass
- 321.4 g/mol
- Monoisotopic mass
- 321.18411237
Names & identifiers
- Preferred name
- 2-(4-(5-cyanopyridin-3-yl)phenyl)-N-isobutyl-2-methylpropanamide
- IUPAC
- 2-[4-(5-cyano-3-pyridinyl)phenyl]-2-methyl-N-(2-methylpropyl)propanamide
Names & synonyms
SCHEMBL2168407NXRMHQDISNPTQA-UHFFFAOYSA-N2-(4-(5-cyanopyridin-3-yl)phenyl)-N-isobutyl-2-methylpropanamide
Database identifiers
- PubChem CID
- 16005196
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 65.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 469
Related reactions
1 records
Compound notes
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