2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide

C19H23ClN2O3S — CID 113154851

IUPAC2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O
InChIInChI=1S/C19H23ClN2O3S/c1-4-14-7-6-8-15(5-2)19(14)21-18(23)13-22(26(3,24)25)17-11-9-16(20)10-12-17/h6-12H,4-5,13H2,1-3H3,(H,21,23)
InChIKeyGPGCTHPPZPHEPB-UHFFFAOYSA-N
MW394.92 g/mol
LogP3.87
Rot. Bonds7

About 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide

2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide (PubChem CID 113154851) has the molecular formula C19H23ClN2O3S and a molecular weight of 394.92 g/mol. Its IUPAC name is 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide
PubChem CID113154851
Molecular FormulaC19H23ClN2O3S
Molecular Weight394.92 g/mol
Exact Mass394.11
IUPAC Name2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O
InChIInChI=1S/C19H23ClN2O3S/c1-4-14-7-6-8-15(5-2)19(14)21-18(23)13-22(26(3,24)25)17-11-9-16(20)10-12-17/h6-12H,4-5,13H2,1-3H3,(H,21,23)
InChIKeyGPGCTHPPZPHEPB-UHFFFAOYSA-N
XLogP3.87
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.92
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)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

N-(2,6-diethylphenyl)-2-(N-methylsulfonylanilino)acetamide
CID 113153665
N-(2,6-diethylphenyl)-2-(4-fluoro-N-methylsulfonylanilino)acetamide
CID 1296238
N-(2-ethyl-6-methylphenyl)-2-(4-fluoro-N-methylsulfonylanilino)acetamide
CID 1317140
2-(2,4-dichloro-N-methylsulfonylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 126413987
2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 126144522
N-(2,6-diethylphenyl)-2-(2,4-dimethyl-N-methylsulfonylanilino)acetamide
CID 113153846
N-(3-chlorophenyl)-2-(4-ethyl-N-methylsulfonylanilino)acetamide
CID 113154183
2-(2-chloro-N-methylsulfonylanilino)-N-(2-ethyl-6-methylphenyl)acetamide
CID 113154792
N-(2-ethylphenyl)-2-(N-methylsulfonylanilino)acetamide
CID 846890
N-(2,6-difluorophenyl)-2-(4-iodo-N-methylsulfonylanilino)acetamide
CID 2208111
2-(4-chloro-N-methylsulfonylanilino)-N-(3-cyanophenyl)acetamide
CID 113154863
2-(4-chloro-N-methylsulfonylanilino)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 1100011

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide?
The IUPAC name of 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide (CID 113154851) is 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide.
What is the SMILES notation for 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide?
The canonical SMILES for 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide is CCc1cccc(CC)c1NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O.
What is the InChIKey of 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide?
The InChIKey is GPGCTHPPZPHEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O3S/c1-4-14-7-6-8-15(5-2)19(14)21-18(23)13-22(26(3,24)25)17-11-9-16(20)10-12-17/h6-12H,4-5,13H2,1-3H3,(H,21,23).
What are the key properties of 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide?
2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide has a molecular weight of 394.92 g/mol, XLogP of 3.87, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-N-methylsulfonylanilino)-N-(2,6-diethylphenyl)acetamide is sourced from PubChem (CID 113154851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).