N-Phenyl-1H-pyrazole-3-carboxamide
Basic information
- CAS
124828-46-2- Standard SMILES
O=C(Nc1ccccc1)c1ccn[nH]1- InChIKey
WMZYZYFPPQOFKY-UHFFFAOYSA-N- Molecular formula
- C10H9N3O
- Average molar mass
- 187.2 g/mol
- Monoisotopic mass
- 187.07456192
Names & identifiers
- Preferred name
- N-Phenyl-1H-pyrazole-3-carboxamide
- IUPAC
- N-phenyl-1H-pyrazole-5-carboxamide
- English name
- N-phenyl-1H-pyrazole-3-carboxamide
- Molecular formula
- C10H9N3O
- Molecular weight
- 187.2
Names & synonyms
N-phenyl-1H-pyrazole-3-carboxamide124828-46-21H-Pyrazole-3-carboxylic Acid Phenylamide1H-pyrazole-3-carboxamide, N-phenyl-LB4UGM0L6NUNII-LB4UGM0L6NRefChem:164106N-phenyl-1H-pyrazole-5-carboxamideMFCD01918907CHEMBL445420MLS0005193012vtl
Show more names
ST034406EU-0015611IDI1_002982ZINC00045763SMR000129720N-phenyl-2H-pyrazole-3-carboxamide
pyrazole amide, 15pyrazole-5-carboxanilideChemDiv2_004267SCHEMBL19748N-phenylpyrazol-3-ylcarboxamideSCHEMBL11758376SCHEMBL13373589BDBM24636
Database identifiers
- CAS
124828-46-2- PubChem CID
- 680935
- ChEMBL
CHEMBL445420- UNII
- LB4UGM0L6N
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 202
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- FDA UNII
- 4 UGM0L6N · LB4UGM0L6N
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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