Basic information
- CAS
38752-62-4- Standard SMILES
O=C(CCC(=O)c1ccc(F)cc1)NCCc1ccccc1- InChIKey
GHXVCTATMQEXCR-UHFFFAOYSA-N- Molecular formula
- C18H18FNO2
- Average molar mass
- 299.3 g/mol
- Monoisotopic mass
- 299.13215698
Names & identifiers
- Preferred name
- 4-(4-Fluorophenyl)-4-oxo-N-(2-phenylethyl)butanimidic acid
- IUPAC
- 4-(4-fluorophenyl)-4-oxo-N-(2-phenylethyl)butanamide
Names & synonyms
DTXSID0095956438752-62-44-(4-Fluorophenyl)-4-oxo-N-(2-phenylethyl)butanimidic acidRefChem:1069955DTXCID001387439BRN 2221284N-(2-Phenylethyl)-3-(4-fluorobenzoyl)propionamide4-Fluoro-gamma-oxo-N-(2-phenylethyl)benzenebutanamideBenzenebutanamide, 4-fluoro-gamma-oxo-N-(2-phenylethyl)-AKOS029488033Z27761747
Database identifiers
- CAS
38752-62-4- PubChem CID
- 217384
- DTXSID
DTXSID00959564
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 358
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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