2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide

C17H17ClN2O3 — CID 964606

IUPAC2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide
SMILESCC(=O)Nc1cccc(OCC(=O)Nc2cc(Cl)ccc2C)c1
InChIInChI=1S/C17H17ClN2O3/c1-11-6-7-13(18)8-16(11)20-17(22)10-23-15-5-3-4-14(9-15)19-12(2)21/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyZOAIZXQNKWHFMR-UHFFFAOYSA-N
MW332.79 g/mol
LogP3.62
Rot. Bonds5

About 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide

2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide (PubChem CID 964606) has the molecular formula C17H17ClN2O3 and a molecular weight of 332.79 g/mol. Its IUPAC name is 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide
PubChem CID964606
Molecular FormulaC17H17ClN2O3
Molecular Weight332.79 g/mol
Exact Mass332.09
IUPAC Name2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide
SMILESCC(=O)Nc1cccc(OCC(=O)Nc2cc(Cl)ccc2C)c1
InChIInChI=1S/C17H17ClN2O3/c1-11-6-7-13(18)8-16(11)20-17(22)10-23-15-5-3-4-14(9-15)19-12(2)21/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyZOAIZXQNKWHFMR-UHFFFAOYSA-N
XLogP3.62
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.79
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide
CID 964612
2-(3-acetamidophenoxy)-N-(3-chloro-2-methylphenyl)acetamide
CID 964555
N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide
CID 2707661
[2-(5-chloro-2-methylanilino)-2-oxoethyl] 2-(3-chlorophenoxy)acetate
CID 7803923
N-(5-chloro-2-methylphenyl)-2-(2-hydroxyphenoxy)acetamide
CID 78770477
N-[3-[2-(5-chloro-2-methoxyanilino)-2-oxoethoxy]phenyl]propanamide
CID 18870278
N-(5-chloro-2-methylphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide
CID 856533
2-(3-acetylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 2454873
N-(4-chloro-2-methylphenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 1122557
N-(5-chloro-2-methylphenyl)-2-(2,3,4,5,6-pentachlorophenoxy)acetamide
CID 19178170
N'-[(Z)-[4-[2-(5-chloro-2-methylanilino)-2-oxoethoxy]phenyl]methylideneamino]-N-(3-chlorophenyl)oxamide
CID 126264692
N-(5-chloro-2-fluorophenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 2554397

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide?
The IUPAC name of 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide (CID 964606) is 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide is CC(=O)Nc1cccc(OCC(=O)Nc2cc(Cl)ccc2C)c1.
What is the InChIKey of 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide?
The InChIKey is ZOAIZXQNKWHFMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O3/c1-11-6-7-13(18)8-16(11)20-17(22)10-23-15-5-3-4-14(9-15)19-12(2)21/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide?
2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide has a molecular weight of 332.79 g/mol, XLogP of 3.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide is sourced from PubChem (CID 964606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).