Basic information
- Standard SMILES
C/C=C/C(=O)Nc1c(C)cccc1C- InChIKey
JGUDBVOIXXBIOV-GQCTYLIASA-N- Molecular formula
- C12H15NO
- Average molar mass
- 189.25 g/mol
- Monoisotopic mass
- 189.1153641
Names & identifiers
- Preferred name
- N-(2,6-dimethylphenyl)crotonamide
- IUPAC
- (E)-N-(2,6-dimethylphenyl)but-2-enamide
Names & synonyms
SCHEMBL11170743JGUDBVOIXXBIOV-GQCTYLIASA-NN-(2,6-dimethylphenyl)crotonamideAKOS003854441
Database identifiers
- PubChem CID
- 6061099
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Related reactions
2 records
Compound notes
Loading…