2-[(3-chlorophenyl)methyl-methylamino]-N-(1-phenylethyl)acetamide
Basic information
- CAS
851614-86-3- Standard SMILES
CC(NC(=O)CN(C)Cc1cccc(Cl)c1)c1ccccc1- InChIKey
OFBJAGWIGNWIDQ-UHFFFAOYSA-N- Molecular formula
- C18H21ClN2O
- Average molar mass
- 316.8 g/mol
- Monoisotopic mass
- 316.134241
Names & identifiers
- Preferred name
- 2-[(3-chlorophenyl)methyl-methylamino]-N-(1-phenylethyl)acetamide
- IUPAC
- 2-[(3-chlorophenyl)methyl-methylamino]-N-(1-phenylethyl)acetamide
Names & synonyms
2-[(3-chlorophenyl)methyl-methylamino]-N-(1-phenylethyl)acetamideMLS001172232CHEMBL1732642DTXSID901323864HMS2896O13AKOS034391214851614-86-3SMR000595310SR-01000063325SR-01000063325-1Z46408399N~2~-[(3-Chlorophenyl)methyl]-N~2~-methyl-N-(1-phenylethyl)glycinamide
Database identifiers
- CAS
851614-86-3- PubChem CID
- 4881897
- DTXSID
DTXSID901323864- ChEMBL
CHEMBL1732642
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 344
Experimental & physicochemical properties
Solubility38.6 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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