Basic information
- Standard SMILES
N#Cc1c(-c2ccc(Oc3ccccc3)cc2)cc(N2CCCCC2)nc1Cl- InChIKey
IIOUHAFGKKJWQH-UHFFFAOYSA-N- Molecular formula
- C23H20ClN3O
- Average molar mass
- 389.9 g/mol
Names & identifiers
- Preferred name
- 2-Chloro-4-(4-phenoxyphenyl)-6-(piperidin-1-yl)nicotinonitrile
- IUPAC
- 2-chloro-4-(4-phenoxyphenyl)-6-piperidin-1-ylpyridine-3-carbonitrile
Names & synonyms
SCHEMBL1162642IIOUHAFGKKJWQH-UHFFFAOYSA-N2-chloro-4-(4-phenoxyphenyl)-6-(piperidin-1-yl)nicotinonitrile
Database identifiers
- PubChem CID
- 86665683
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 49.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 529
Related reactions
2 records
Compound notes
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