2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide

C17H15ClN2O4 — CID 8975756

IUPAC2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(NC(=O)COc2ccc(C#N)cc2Cl)c1
InChIInChI=1S/C17H15ClN2O4/c1-22-12-4-6-16(23-2)14(8-12)20-17(21)10-24-15-5-3-11(9-19)7-13(15)18/h3-8H,10H2,1-2H3,(H,20,21)
InChIKeyQDJPOSDTTKUMLU-UHFFFAOYSA-N
MW346.77 g/mol
LogP3.25
Rot. Bonds6

About 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide

2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide (PubChem CID 8975756) has the molecular formula C17H15ClN2O4 and a molecular weight of 346.77 g/mol. Its IUPAC name is 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide
PubChem CID8975756
Molecular FormulaC17H15ClN2O4
Molecular Weight346.77 g/mol
Exact Mass346.07
IUPAC Name2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide
SMILESCOc1ccc(OC)c(NC(=O)COc2ccc(C#N)cc2Cl)c1
InChIInChI=1S/C17H15ClN2O4/c1-22-12-4-6-16(23-2)14(8-12)20-17(21)10-24-15-5-3-11(9-19)7-13(15)18/h3-8H,10H2,1-2H3,(H,20,21)
InChIKeyQDJPOSDTTKUMLU-UHFFFAOYSA-N
XLogP3.25
TPSA80.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.77
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)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-(2-chloro-4-cyanophenoxy)-N-(4-methoxyphenyl)acetamide
CID 8975814
N-(5-chloro-2-methoxyphenyl)-2-(4-cyanophenoxy)acetamide
CID 7503472
2-(2-chloro-4-cyanophenoxy)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]acetamide
CID 55404926
2-(2-chloro-4-nitrophenoxy)-N-(2,5-dimethoxyphenyl)acetamide
CID 2513285
2-(2-chloro-5-methylphenoxy)-N-(2,5-dimethoxyphenyl)acetamide
CID 7778322
N-(2,5-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 676177
N-(2-chloro-4-methylphenyl)-2-(4-cyano-2-methoxyphenoxy)acetamide
CID 7252194
N-(5-acetamido-2-methoxyphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 9019861
2-(2,4-dibromophenoxy)-N-(2,5-dimethoxyphenyl)acetamide
CID 1181190
N-(3-cyanophenyl)-N'-(2,5-dimethoxyphenyl)propanediamide
CID 108955950
2-(2-chloro-4-cyanophenoxy)-N-propan-2-ylacetamide
CID 8976290
1-[[2-(2,4-dichlorophenoxy)acetyl]amino]-3-(2,5-dimethoxyphenyl)thiourea
CID 17283054

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide?
The IUPAC name of 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide (CID 8975756) is 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide?
The canonical SMILES for 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide is COc1ccc(OC)c(NC(=O)COc2ccc(C#N)cc2Cl)c1.
What is the InChIKey of 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide?
The InChIKey is QDJPOSDTTKUMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O4/c1-22-12-4-6-16(23-2)14(8-12)20-17(21)10-24-15-5-3-11(9-19)7-13(15)18/h3-8H,10H2,1-2H3,(H,20,21).
What are the key properties of 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide?
2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide has a molecular weight of 346.77 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-cyanophenoxy)-N-(2,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 8975756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).