Basic information
- Standard SMILES
Cc1ccccc1-n1[nH]c(C(N)=O)cc1=O- InChIKey
IDBDRHVWSLKLIV-UHFFFAOYSA-N- Molecular formula
- C11H11N3O2
- Average molar mass
- 217.22 g/mol
Names & identifiers
- Preferred name
- 3-Carbamoyl-1-(2-methylphenyl)-5-pyrazolone
- IUPAC
- 2-(2-methylphenyl)-3-oxo-1H-pyrazole-5-carboxamide
Names & synonyms
SCHEMBL10607813IDBDRHVWSLKLIV-UHFFFAOYSA-N3-carbamoyl-1-(2-methylphenyl)-5-pyrazolone
Database identifiers
- PubChem CID
- 20152108
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 351
Related reactions
1 records
Compound notes
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