5-cyano-1-methyl-1H-pyrazole-3-carboxamide
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Basic information
- CAS
203792-52-3- Standard SMILES
Cn1nc(C(N)=O)cc1C#N- InChIKey
GOLCVQAURPFKKC-UHFFFAOYSA-N- Molecular formula
- C6H6N4O
- Average molar mass
- 150.14 g/mol
- Monoisotopic mass
- 150.05416083
Names & identifiers
- Preferred name
- 5-cyano-1-methyl-1H-pyrazole-3-carboxamide
- IUPAC
- 5-cyano-1-methylpyrazole-3-carboxamide
- English name
- 1H-Pyrazole-3-carboxamide,5-cyano-1-methyl-(9CI)
- Molecular formula
- C6H6N4O
- Molecular weight
- 150.14
Names & synonyms
203792-52-35-cyano-1-methyl-1H-pyrazole-3-carboxamideSCHEMBL6825854DB-2795181H-Pyrazole-3-carboxamide, 5-cyano-1-methyl-1H-Pyrazole-3-carboxamide,5-cyano-1-methyl-(9CI)
Database identifiers
- CAS
203792-52-3- PubChem CID
- 22715984
Properties
Computed structural propertiesFilling in
- XLogP
- -0.5
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 218
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
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Compound notes
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