Basic information
- Standard SMILES
C=CCC(Cc1ccc(Cl)cc1)NC(C)=O- InChIKey
BGDCUHLIASUMDL-UHFFFAOYSA-N- Molecular formula
- C13H16ClNO
- Average molar mass
- 237.72 g/mol
Names & identifiers
- Preferred name
- Racemic 2-acetylamino-1(4-chlorophenyl)-4-pentene
- IUPAC
- N-[1-(4-chlorophenyl)pent-4-en-2-yl]acetamide
Names & synonyms
SCHEMBL5036948BGDCUHLIASUMDL-UHFFFAOYSA-Nracemic 2-acetylamino-1(4-chlorophenyl)-4-pentene
Database identifiers
- PubChem CID
- 21993384
- Nikkaji
- J1.252.576A
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 234
Related reactions
2 records
Compound notes
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