Basic information
- Standard SMILES
CCOc1ccc(N(C(=O)c2cnccc2C)C2CCN(C(C)CC#N)CC2)cc1- InChIKey
LQGCXVQDNVKUJM-UHFFFAOYSA-N- Molecular formula
- C24H30N4O2
- Average molar mass
- 406.5 g/mol
Names & identifiers
- Preferred name
- N-[1-(1-cyanopropan-2-yl)piperidin-4-yl]-N-(4-ethoxyphenyl)-4-methylpyridine-3-carboxamide
- IUPAC
- N-[1-(1-cyanopropan-2-yl)piperidin-4-yl]-N-(4-ethoxyphenyl)-4-methylpyridine-3-carboxamide
Names & synonyms
SCHEMBL4249970
Database identifiers
- PubChem CID
- 68974791
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 69.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 587
Related reactions
1 records
Compound notes
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