3-(2-chlorophenyl)-N-cyclopentyl-5-methyl-1,2-oxazole-4-carboxamide
Basic information
- CAS
326902-72-1- Standard SMILES
Cc1onc(-c2ccccc2Cl)c1C(=O)NC1CCCC1- InChIKey
JAQFHSDXNIAHBZ-UHFFFAOYSA-N- Molecular formula
- C16H17ClN2O2
- Average molar mass
- 304.77 g/mol
- Monoisotopic mass
- 304.0978555
Names & identifiers
- Preferred name
- 3-(2-chlorophenyl)-N-cyclopentyl-5-methyl-1,2-oxazole-4-carboxamide
- IUPAC
- 3-(2-chlorophenyl)-N-cyclopentyl-5-methyl-1,2-oxazole-4-carboxamide
- English name
- 3-(2-chlorophenyl)-N-cyclopentyl-5-methyl-4-isoxazolecarboxamide
- Molecular formula
- C16H17ClN2O2
- Molecular weight
- 304.77
Names & synonyms
3-(2-chlorophenyl)-N-cyclopentyl-5-methyl-1,2-oxazole-4-carboxamide326902-72-1ZINC00029868Oprea1_281318Oprea1_590062STK074244AKOS000675353ST042907EU-0035626AG-690/37071230SR-01000407379SR-01000407379-1
Show more names
4-Isoxazolecarboxamide, 3-(2-chlorophenyl)-N-cyclopentyl-5-methyl-
Z30919945[3-(2-chlorophenyl)-5-methylisoxazol-4-yl]-N-cyclopentylcarboxamide3-(2-chlorophenyl)-N-cyclopentyl-5-methyl-4-isoxazolecarboxamide3-(2-chlorophenyl)-N-cyclopentyl-5-methylisoxazole-4-carboxamide
Database identifiers
- CAS
326902-72-1- PubChem CID
- 669301
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 373
Physicochemical properties
- Boiling point
- 457.3 · 457.3±45.0 °C(Predicted)
- Density
- 1.28 · 1.28±0.1 g/cm3(Predicted)
- pka
- 13.74 · 13.74±0.20(Predicted)
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Compound notes
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