N-benzyl-2-cyclohexylacetamide
Basic information
- CAS
192879-51-9- Standard SMILES
O=C(CC1CCCCC1)NCc1ccccc1- InChIKey
GJTUFBPQCIXLCW-UHFFFAOYSA-N- Molecular formula
- C15H21NO
- Average molar mass
- 231.33 g/mol
- Monoisotopic mass
- 231.16231429
Names & identifiers
- Preferred name
- N-benzyl-2-cyclohexylacetamide
- IUPAC
- N-benzyl-2-cyclohexylacetamide
Names & synonyms
N-benzyl-2-cyclohexylacetamidecyclohexaneacetamide, n-(phenylmethyl)-192879-51-9CBMicro_031866MLS001001378CHEMBL1400307SCHEMBL14724834DTXSID10358206GJTUFBPQCIXLCW-UHFFFAOYSA-NHMS2813K22STK222762AKOS003266460
Show more names
SMR000496990BIM-0031949.P0016368-63-4
Database identifiers
- CAS
192879-51-9- PubChem CID
- 880904
- DTXSID
DTXSID10358206- ChEMBL
CHEMBL1400307- Nikkaji
- J3.276.678A
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 227
Experimental & physicochemical properties
Solubility30.5 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…