Basic information
- CAS
68386-85-6- Standard SMILES
N#CC(C(N)=O)C(CC(=O)c1ccccc1)c1ccccc1- InChIKey
BSUBFGTXOWTBKV-UHFFFAOYSA-N- Molecular formula
- C18H16N2O2
- Average molar mass
- 292.3 g/mol
- Monoisotopic mass
- 292.12117776
Names & identifiers
- Preferred name
- 2-Cyano-5-oxo-3,5-diphenylpentanamide
- IUPAC
- 2-cyano-5-oxo-3,5-diphenylpentanamide
Names & synonyms
2-Cyano-5-oxo-3,5-diphenylpentanamide68386-85-6NSC349813NSC 349813DTXSID90987937NSC-3498132-cyano-5-oxo-3,5-diphenyl-pentanamide2-Cyano-5-oxo-3,5-diphenylpentanimidic acid
Database identifiers
- CAS
68386-85-6- PubChem CID
- 336243
- DTXSID
DTXSID90987937- Nikkaji
- J1.183.485J
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 439
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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