2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide

C18H21ClN2O2 — CID 109002864

IUPAC2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CNCCc1ccc(Cl)cc1
InChIInChI=1S/C18H21ClN2O2/c1-2-23-17-6-4-3-5-16(17)21-18(22)13-20-12-11-14-7-9-15(19)10-8-14/h3-10,20H,2,11-13H2,1H3,(H,21,22)
InChIKeyWYOFJWQMZHLSNU-UHFFFAOYSA-N
MW332.83 g/mol
LogP3.51
Rot. Bonds8

About 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide

2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide (PubChem CID 109002864) has the molecular formula C18H21ClN2O2 and a molecular weight of 332.83 g/mol. Its IUPAC name is 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide
PubChem CID109002864
Molecular FormulaC18H21ClN2O2
Molecular Weight332.83 g/mol
Exact Mass332.13
IUPAC Name2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CNCCc1ccc(Cl)cc1
InChIInChI=1S/C18H21ClN2O2/c1-2-23-17-6-4-3-5-16(17)21-18(22)13-20-12-11-14-7-9-15(19)10-8-14/h3-10,20H,2,11-13H2,1H3,(H,21,22)
InChIKeyWYOFJWQMZHLSNU-UHFFFAOYSA-N
XLogP3.51
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.83
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-(4-chlorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 109002867
N-(2-ethoxyphenyl)-2-(2-hydroxyethylamino)acetamide
CID 82358452
N-[(4-chlorophenyl)methyl]-N'-(2-ethoxyphenyl)propanediamide
CID 108946779
2-[(4-chlorophenyl)methylsulfanyl]-N-(2-ethoxyphenyl)acetamide
CID 2075755
N-(2-ethoxyphenyl)-2-(3-methylbutylamino)acetamide
CID 109005835
2-(5-chloro-2-methylanilino)-N-(2-ethoxyphenyl)acetamide
CID 9102968
N-(4-chloro-2-methylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955185
2-(4-chlorophenyl)-N-[(2-ethoxyphenyl)carbamothioyl]acetamide
CID 889519
2-[2-(4-chlorophenyl)ethylamino]-N-(4-ethylphenyl)acetamide
CID 109002843
N-(2-ethoxyphenyl)-3-phenylpropanamide
CID 849126
N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide
CID 108952937
N-(3-chloro-2-methylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955086

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide?
The IUPAC name of 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide (CID 109002864) is 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide?
The canonical SMILES for 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide is CCOc1ccccc1NC(=O)CNCCc1ccc(Cl)cc1.
What is the InChIKey of 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide?
The InChIKey is WYOFJWQMZHLSNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O2/c1-2-23-17-6-4-3-5-16(17)21-18(22)13-20-12-11-14-7-9-15(19)10-8-14/h3-10,20H,2,11-13H2,1H3,(H,21,22).
What are the key properties of 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide?
2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide has a molecular weight of 332.83 g/mol, XLogP of 3.51, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-chlorophenyl)ethylamino]-N-(2-ethoxyphenyl)acetamide is sourced from PubChem (CID 109002864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).