2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide

C18H20ClNO3 — CID 4942951

IUPAC2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)COc2ccc(Cl)c(C)c2)cc1
InChIInChI=1S/C18H20ClNO3/c1-3-10-22-15-6-4-14(5-7-15)20-18(21)12-23-16-8-9-17(19)13(2)11-16/h4-9,11H,3,10,12H2,1-2H3,(H,20,21)
InChIKeyQJNQFFXEDNNLMF-UHFFFAOYSA-N
MW333.82 g/mol
LogP4.45
Rot. Bonds7

About 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide

2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide (PubChem CID 4942951) has the molecular formula C18H20ClNO3 and a molecular weight of 333.82 g/mol. Its IUPAC name is 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide
PubChem CID4942951
Molecular FormulaC18H20ClNO3
Molecular Weight333.82 g/mol
Exact Mass333.11
IUPAC Name2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)COc2ccc(Cl)c(C)c2)cc1
InChIInChI=1S/C18H20ClNO3/c1-3-10-22-15-6-4-14(5-7-15)20-18(21)12-23-16-8-9-17(19)13(2)11-16/h4-9,11H,3,10,12H2,1-2H3,(H,20,21)
InChIKeyQJNQFFXEDNNLMF-UHFFFAOYSA-N
XLogP4.45
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.82
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-chloro-3-methylphenoxy)-N-(4-ethylphenyl)acetamide
CID 841196
4-(4-chloro-3-methylphenoxy)-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]butanamide
CID 32937961
2-(4-methylphenoxy)-N-(4-propoxyphenyl)acetamide
CID 4943007
2-(4-chloro-3-methylphenoxy)-N-(3-hexoxyphenyl)acetamide
CID 17094710
2-(4-chloro-3-methylphenoxy)-N-(4-methylsulfonylphenyl)acetamide
CID 18076736
N-(4-methoxyphenyl)-2-(4-propoxyphenoxy)acetamide
CID 4732668
2-(4-chloro-3-methylphenoxy)-N'-[2-(4-chloro-3-methylphenoxy)acetyl]acetohydrazide
CID 3554706
ethyl 2-chloro-4-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]benzoate
CID 99952962
2-(4-chloro-3-methylphenoxy)-N-[4-(4-ethylpiperazin-1-yl)phenyl]acetamide
CID 3793985
2-(4-tert-butylphenoxy)-N-(4-propoxyphenyl)acetamide
CID 4945067
2-(4-chloro-3,5-dimethylphenoxy)-N-[4-(2-phenoxyethoxy)phenyl]acetamide
CID 4958111
2-(4-chloro-3-methylphenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 9140969

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide?
The IUPAC name of 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide (CID 4942951) is 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide?
The canonical SMILES for 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide is CCCOc1ccc(NC(=O)COc2ccc(Cl)c(C)c2)cc1.
What is the InChIKey of 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide?
The InChIKey is QJNQFFXEDNNLMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO3/c1-3-10-22-15-6-4-14(5-7-15)20-18(21)12-23-16-8-9-17(19)13(2)11-16/h4-9,11H,3,10,12H2,1-2H3,(H,20,21).
What are the key properties of 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide?
2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide has a molecular weight of 333.82 g/mol, XLogP of 4.45, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-methylphenoxy)-N-(4-propoxyphenyl)acetamide is sourced from PubChem (CID 4942951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).