Basic information
- Standard SMILES
C#Cc1cnc(C(N)=O)n1C- InChIKey
IUYKBAFHGCMKGN-UHFFFAOYSA-N- Molecular formula
- C7H7N3O
- Average molar mass
- 149.15 g/mol
Names & identifiers
- Preferred name
- 5-Ethynyl-1-methyl-1h-imidazole-2-carboxamide
- IUPAC
- 5-ethynyl-1-methylimidazole-2-carboxamide
Names & synonyms
5-ethynyl-1-methyl-1h-imidazole-2-carboxamideSCHEMBL4102422IUYKBAFHGCMKGN-UHFFFAOYSA-N957147-20-5DB-2071085-Ethynyl-1-methyl-1H-imidazole-2-carboxylic acid amid5-Ethynyl-1-methyl-1H-imidazole-2-carboxylic acid amide
Database identifiers
- PubChem CID
- 57737405
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 217
Related reactions
4 records
Compound notes
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