Basic information
- CAS
125103-52-8- Standard SMILES
Cc1nn(-c2ccccc2)c(C)c1CC(=O)NC(C)(C)C- InChIKey
SUAPPBWCVXMGNG-UHFFFAOYSA-N- Molecular formula
- C17H23N3O
- Average molar mass
- 285.4 g/mol
- Monoisotopic mass
- 285.18411237
Names & identifiers
- Preferred name
- 1H-Pyrazole-4-acetamide, 3,5-dimethyl-N-(1,1-dimethylethyl)-1-phenyl-
- IUPAC
- N-tert-butyl-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetamide
Names & synonyms
BRN 41944351H-Pyrazole-4-acetamide, 3,5-dimethyl-N-(1,1-dimethylethyl)-1-phenyl-125103-52-83,5-Dimethyl-N-(1,1-dimethylethyl)-1-phenyl-1H-pyrazole-4-acetamideDTXSID10154649RefChem:239945DTXCID0077140N-tert-Butyl-2-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)acetamide
Database identifiers
- CAS
125103-52-8- PubChem CID
- 3079321
- DTXSID
DTXSID10154649
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 358
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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