Basic information
- Standard SMILES
C=CC(=O)Nc1c(C)cccc1C(=O)NC(C)C- InChIKey
IFIBJIJJINIUMW-UHFFFAOYSA-N- Molecular formula
- C14H18N2O2
- Average molar mass
- 246.3 g/mol
- Monoisotopic mass
- 246.13682782
Names & identifiers
- Preferred name
- 3-Methyl-n-(1-methylethyl)-2-[(1-oxo-2-propenyl)amino]benzamide
- IUPAC
- 3-methyl-N-propan-2-yl-2-(prop-2-enoylamino)benzamide
Names & synonyms
SCHEMBL5211177IFIBJIJJINIUMW-UHFFFAOYSA-N3-methyl-n-(1-methylethyl)-2-[(1-oxo-2-propenyl)amino]benzamide
Database identifiers
- PubChem CID
- 21990847
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 326
Related reactions
1 records
Compound notes
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