N-(1-Methyl-3-phenylpropyl)-2-phenoxyacetamide
Basic information
- CAS
545356-86-3- Standard SMILES
CC(CCc1ccccc1)NC(=O)COc1ccccc1- InChIKey
HQIFKIVASLTXKP-UHFFFAOYSA-N- Molecular formula
- C18H21NO2
- Average molar mass
- 283.4 g/mol
- Monoisotopic mass
- 283.15722891
Names & identifiers
- Preferred name
- N-(1-Methyl-3-phenylpropyl)-2-phenoxyacetamide
- IUPAC
- 2-phenoxy-N-(4-phenylbutan-2-yl)acetamide
- English name
- N-(1-Methyl-3-phenylpropyl)-2-phenoxyacetamide
- Molecular formula
- C18H21NO2
- Molecular weight
- 283.37
Names & synonyms
AKOS003797795N-(1-METHYL-3-PHENYLPROPYL)-2-PHENOXYACETAMIDEAcetamide, N-(1-methyl-3-phenylpropyl)-2-phenoxy-
Database identifiers
- CAS
545356-86-3- PubChem CID
- 5147464
- EC Number
- 140-392-1
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 294
Physicochemical properties
- Boiling point
- 487.956 · 487.956±38.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.077 · 1.077±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 14.457 · 14.457±0.46(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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