Basic information
- Standard SMILES
Cc1cc(C(=O)NCCc2ccccc2)n(C)n1- InChIKey
YGPIVZXWMJEBSS-UHFFFAOYSA-N- Molecular formula
- C14H17N3O
- Average molar mass
- 243.3 g/mol
- Monoisotopic mass
- 243.13716217
Names & identifiers
- Preferred name
- 2,5-dimethyl-2H-pyrazole-3-carboxylic acid phenethyl-amide
- IUPAC
- 2,5-dimethyl-N-(2-phenylethyl)pyrazole-3-carboxamide
Names & synonyms
SCHEMBL7699111YGPIVZXWMJEBSS-UHFFFAOYSA-NAKOS027589176Z7338998382,5-dimethyl-2H-pyrazole-3-carboxylic acid phenethyl-amide
Database identifiers
- PubChem CID
- 35764050
- Nikkaji
- J529.757E
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 276
Related reactions
2 records
Compound notes
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