Basic information
- Standard SMILES
Cn1cncc1C1=CCCCC1=O- InChIKey
QUFFRLCSXLWNQT-UHFFFAOYSA-N- Molecular formula
- C10H12N2O
- Average molar mass
- 176.21 g/mol
Names & identifiers
- Preferred name
- 2-(3-Methylimidazol-4-yl)cyclohex-2-en-1-one
- IUPAC
- 2-(3-methylimidazol-4-yl)cyclohex-2-en-1-one
Names & synonyms
1450597-16-62-(3-methylimidazol-4-yl)cyclohex-2-en-1-oneSCHEMBL15465627QUFFRLCSXLWNQT-UHFFFAOYSA-NDA-287872-(1-Methyl-1H-imidazol-5-yl)cyclohex-2-en-1-one
Database identifiers
- PubChem CID
- 89963299
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 247
Related reactions
2 records
Compound notes
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