Basic information
- Standard SMILES
C#Cc1cnc(C(=O)c2ccccc2)n1C- InChIKey
RPAULTIDFOIFFF-UHFFFAOYSA-N- Molecular formula
- C13H10N2O
- Average molar mass
- 210.23 g/mol
Names & identifiers
- Preferred name
- (5-Ethynyl-1-methyl-1H-imidazol-2-yl)-phenyl-methanone
- IUPAC
- (5-ethynyl-1-methylimidazol-2-yl)-phenylmethanone
Names & synonyms
SCHEMBL4036067RPAULTIDFOIFFF-UHFFFAOYSA-N(5-Ethynyl-1-methyl-1H-imidazol-2-yl)-phenyl-methanone
Database identifiers
- PubChem CID
- 21097345
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 311
Related reactions
9 records
Compound notes
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