N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide

C17H18Cl2N2O4S — CID 30270996

IUPACN-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
SMILESCCOc1cccc(N(CC(=O)Nc2cccc(Cl)c2Cl)S(C)(=O)=O)c1
InChIInChI=1S/C17H18Cl2N2O4S/c1-3-25-13-7-4-6-12(10-13)21(26(2,23)24)11-16(22)20-15-9-5-8-14(18)17(15)19/h4-10H,3,11H2,1-2H3,(H,20,22)
InChIKeyMMDRGVXQQWUYSH-UHFFFAOYSA-N
MW417.31 g/mol
LogP3.80
Rot. Bonds7

About N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide

N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide (PubChem CID 30270996) has the molecular formula C17H18Cl2N2O4S and a molecular weight of 417.31 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
PubChem CID30270996
Molecular FormulaC17H18Cl2N2O4S
Molecular Weight417.31 g/mol
Exact Mass416.04
IUPAC NameN-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
SMILESCCOc1cccc(N(CC(=O)Nc2cccc(Cl)c2Cl)S(C)(=O)=O)c1
InChIInChI=1S/C17H18Cl2N2O4S/c1-3-25-13-7-4-6-12(10-13)21(26(2,23)24)11-16(22)20-15-9-5-8-14(18)17(15)19/h4-10H,3,11H2,1-2H3,(H,20,22)
InChIKeyMMDRGVXQQWUYSH-UHFFFAOYSA-N
XLogP3.80
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.31
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)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-(3-ethoxy-N-methylsulfonylanilino)-N-(2-fluorophenyl)acetamide
CID 30264702
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
CID 30268918
N-(5-chloro-2-methoxyphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
CID 30264909
N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
CID 30258396
2-(3-ethoxy-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide
CID 30257958
2-(3-ethoxy-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide
CID 30262151
N-benzyl-2-[[2-(3-ethoxy-N-methylsulfonylanilino)acetyl]amino]benzamide
CID 30267975
N-(2,3-dichlorophenyl)-2-(2,4,5-trichloro-N-methylsulfonylanilino)acetamide
CID 2233147
2-(3-ethoxy-N-methylsulfonylanilino)-N-(2-methyl-5-nitrophenyl)acetamide
CID 30270152
methyl 3-[[2-(3-ethoxy-N-methylsulfonylanilino)acetyl]amino]benzoate
CID 30272698
2-(3-ethoxy-N-methylsulfonylanilino)-N,N-diethylacetamide
CID 30256331
2-[[2-(3-ethoxy-N-methylsulfonylanilino)acetyl]amino]-N-(pyridin-3-ylmethyl)benzamide
CID 30276150

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide (CID 30270996) is N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide is CCOc1cccc(N(CC(=O)Nc2cccc(Cl)c2Cl)S(C)(=O)=O)c1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide?
The InChIKey is MMDRGVXQQWUYSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O4S/c1-3-25-13-7-4-6-12(10-13)21(26(2,23)24)11-16(22)20-15-9-5-8-14(18)17(15)19/h4-10H,3,11H2,1-2H3,(H,20,22).
What are the key properties of N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide?
N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide has a molecular weight of 417.31 g/mol, XLogP of 3.80, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide is sourced from PubChem (CID 30270996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).