Basic information
- CAS
50427-81-1- Standard SMILES
Cc1nn(-c2ccccc2)c(N)c1C(N)=O- InChIKey
MUCXQQXKBTVCRB-UHFFFAOYSA-N- Molecular formula
- C11H12N4O
- Average molar mass
- 216.24 g/mol
- Monoisotopic mass
- 216.10111102
Names & identifiers
- Preferred name
- 5-Amino-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide
- IUPAC
- 5-amino-3-methyl-1-phenylpyrazole-4-carboxamide
Names & synonyms
5-amino-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide50427-81-1DTXSID60578750RefChem:301021DTXCID305295171H-Pyrazole-4-carboxamide, 5-amino-3-methyl-1-phenyl-MFCD125470015-AMINO-3-METHYL-1-PHENYLPYRAZOLE-4-CARBOXAMIDESCHEMBL2546507MUCXQQXKBTVCRB-UHFFFAOYSA-NAKOS005256538F70644
Show more names
5-amino-3-methyl-1-phenyl-pyrazole-4-carboxamide
Database identifiers
- CAS
50427-81-1- PubChem CID
- 15836765
- DTXSID
DTXSID60578750- Nikkaji
- J2.309.823G
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 265
Related reactions
3 records
Compound notes
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