Basic information
- Standard SMILES
CCC(=O)c1ccn(C)c(=O)c1- InChIKey
SXADCDPKMWWSGN-UHFFFAOYSA-N- Molecular formula
- C9H11NO2
- Average molar mass
- 165.19 g/mol
Names & identifiers
- Preferred name
- 1-methyl-4-propionylpyridin-2(1H)-one
- IUPAC
- 1-methyl-4-propanoylpyridin-2-one
Names & synonyms
SCHEMBL15069309SXADCDPKMWWSGN-UHFFFAOYSA-N1-methyl-4-propionylpyridin-2(1H)-one
Database identifiers
- PubChem CID
- 89657354
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 276
Related reactions
2 records
Compound notes
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