N-(4-acetyl-1H-pyrazol-5-yl)benzamide
Basic information
- CAS
67560-26-3- Standard SMILES
CC(=O)c1cn[nH]c1NC(=O)c1ccccc1- InChIKey
PUTGCUCYPOJXDV-UHFFFAOYSA-N- Molecular formula
- C12H11N3O2
- Average molar mass
- 229.23 g/mol
- Monoisotopic mass
- 229.0851266
Names & identifiers
- Preferred name
- N-(4-acetyl-1H-pyrazol-5-yl)benzamide
- IUPAC
- N-(4-acetyl-1H-pyrazol-5-yl)benzamide
Names & synonyms
N-(4-acetyl-1H-pyrazol-5-yl)benzamide67560-26-3DTXSID20321880RefChem:361686DTXCID70272999NSC382783N-(4-ACETYL-2H-PYRAZOL-3-YL)BENZAMIDENSC-382783DS-001933
Database identifiers
- CAS
67560-26-3- PubChem CID
- 343365
- DTXSID
DTXSID20321880- Nikkaji
- J2.521.563J
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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