1-(3-chlorophenyl)-N-methoxy-N-methyl-5-(trifluoromethyl)pyrazole-4-carboxamide
Basic information
- CAS
98534-47-5- Standard SMILES
CON(C)C(=O)c1cnn(-c2cccc(Cl)c2)c1C(F)(F)F- InChIKey
PNKOYOJVBCQKHW-UHFFFAOYSA-N- Molecular formula
- C13H11ClF3N3O2
- Average molar mass
- 333.69 g/mol
- Monoisotopic mass
- 333.0491888
Names & identifiers
- Preferred name
- 1-(3-chlorophenyl)-N-methoxy-N-methyl-5-(trifluoromethyl)pyrazole-4-carboxamide
- IUPAC
- 1-(3-chlorophenyl)-N-methoxy-N-methyl-5-(trifluoromethyl)pyrazole-4-carboxamide
Names & synonyms
1-(3-chlorophenyl)-N-methoxy-N-methyl-5-(trifluoromethyl)pyrazole-4-carboxamide98534-47-51H-Pyrazole-4-carboxamide, 1-(3-chlorophenyl)-N-methoxy-N-methyl-5-(trifluoromethyl)-SCHEMBL10367017DTXSID00243692PNKOYOJVBCQKHW-UHFFFAOYSA-N1-(3-Chlorophenyl)-N-methoxy-N-methyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide
Database identifiers
- CAS
98534-47-5- PubChem CID
- 176757
- DTXSID
DTXSID00243692
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 47.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 410
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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