N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-phenylacetamide

HCID 288409

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 4876-02-2
Standard SMILES: COc1ccc(CCNC(=O)Cc2ccccc2)cc1OC
InChIKey: HVABELWWEQMYIB-UHFFFAOYSA-N
Molecular formula: C18H21NO3
Average molar mass: 299.4 g/mol
Monoisotopic mass: 299.15214353

Names & identifiers

Preferred name: N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-phenylacetamide
IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylacetamide

Names & synonyms

N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-phenylacetamide4876-02-2N-[2-(3,4-Dimethoxy-phenyl)-ethyl]-2-phenyl-acetamideN-(2-(3,4-DIMETHOXY-PHENYL)-ETHYL)-2-PHENYL-ACETAMIDENSC168206N-(3,4-Dimethoxyphenethyl)-2-phenylacetamideOprea1_314422Oprea1_590733MLS001212311SCHEMBL6380843CHEMBL1895008SCHEMBL28266120

Show more names

DTXSID00302192HMS2815B11NSC149608STK126506AKOS000612280HS-8795NSC-149608NSC-168206

Database identifiers

CAS: 4876-02-2
PubChem CID: 288409
DTXSID: DTXSID00302192
ChEMBL: CHEMBL1895008
EC Number: 105-241-6
Nikkaji: J1.265.962H

Properties

Computed structural properties

XLogP: 2.6
Topological polar surface area: 47.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 7
Heavy atoms: 22
Formal charge: 0
Complexity: 328

Related reactions

2 records

New reaction record

HRID 48575As productuspto-grants-2004_03

HRID 818393As productTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

Loading…