Basic information
- CAS
5334-42-9- Standard SMILES
CC(=O)Nc1c(C#N)cnn1C- InChIKey
NINCIFZSQMSSFI-UHFFFAOYSA-N- Molecular formula
- C7H8N4O
- Average molar mass
- 164.16 g/mol
- Monoisotopic mass
- 164.06981089
Names & identifiers
- Preferred name
- n-(4-Cyano-1-methyl-1h-pyrazol-5-yl)acetamide
- IUPAC
- N-(4-cyano-1-methylpyrazol-5-yl)acetamide
Names & synonyms
n-(4-cyano-1-methyl-1h-pyrazol-5-yl)acetamide5334-42-9NSC-1413NSC1413N-(4-cyano-2-methylpyrazol-3-yl)acetamideZN8D5RJ4LB5-ACETAMIDO-1-METHYLPYRAZOLE-4-CARBONITRILEDTXSID90967956AKOS017269731CS-0453335N-(4-cyano-2-methyl-pyrazol-3-yl)acetamideAcetamide, N-(4-cyano-1-methylpyrazol-5-yl)-
Show more names
Pyrazole-4-carbonitrile, 5-acetamido-1-methyl-Acetamide, N-(4-cyano-1-methyl-1H-pyrazol-5-yl)-F2199-0331N-(4-Cyano-1-methyl-1H-pyrazol-5-yl)ethanimidic acid
Database identifiers
- CAS
5334-42-9- PubChem CID
- 219741
- DTXSID
DTXSID90967956- UNII
- ZN8D5RJ4LB
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 70.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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