6-Butyryl-1-methyl-2(1H)-quinolinone
Basic information
- Standard SMILES
CCCC(=O)c1ccc2c(ccc(=O)n2C)c1- InChIKey
LJDDIPKYAIBOHD-UHFFFAOYSA-N- Molecular formula
- C14H15NO2
- Average molar mass
- 229.27 g/mol
- Monoisotopic mass
- 229.11027872
Names & identifiers
- Preferred name
- 6-Butyryl-1-methyl-2(1H)-quinolinone
- IUPAC
- 6-butanoyl-1-methylquinolin-2-one
Names & synonyms
NSC6429206-Butyryl-1-methyl-2(1H)-quinolinoneCHEMBL19680276-butanoyl-1-methyl-quinolin-2-oneNSC-642920NCI60_014504
Database identifiers
- PubChem CID
- 370176
- ChEMBL
CHEMBL1968027
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 348
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…