Basic information
- Standard SMILES
O=C1CCc2cc(C=CCn3ccnc3)ccc2N1- InChIKey
BTZUCPGQSOUNML-UHFFFAOYSA-N- Molecular formula
- C15H15N3O
- Average molar mass
- 253.3 g/mol
- Monoisotopic mass
- 253.12151211
Names & identifiers
- Preferred name
- 6-[3-(Imidazol-1-yl)prop-1-en-1-yl]-3,4-dihydrocarbostyril
- IUPAC
- 6-(3-imidazol-1-ylprop-1-enyl)-3,4-dihydro-1H-quinolin-2-one
Names & synonyms
SCHEMBL6963344BTZUCPGQSOUNML-UHFFFAOYSA-N6-[3-(imidazol-1-yl)prop-1-en-1-yl]-3,4-dihydrocarbostyril
Database identifiers
- PubChem CID
- 53701159
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 355
Related reactions
2 records
Compound notes
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