Basic information
- Standard SMILES
CC(=O)Nc1ncn(Cc2ccccc2)c1C(N)=O- InChIKey
ITDORXBLKFZHMR-UHFFFAOYSA-N- Molecular formula
- C13H14N4O2
- Average molar mass
- 258.28 g/mol
- Monoisotopic mass
- 258.1116757
Names & identifiers
- Preferred name
- 4-Acetylamino-1-benzyl-5-imidazolecarboxamide
- IUPAC
- 5-acetamido-3-benzylimidazole-4-carboxamide
Names & synonyms
SCHEMBL7988350ITDORXBLKFZHMR-UHFFFAOYSA-N4-acetylamino-1-benzyl-5-imidazolecarboxamide
Database identifiers
- PubChem CID
- 18360341
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 90 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 342
Related reactions
2 records
Compound notes
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