2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide

C16H15Cl3N2O3S — CID 34055922

IUPAC2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide
SMILESCc1ccc(Cl)cc1S(=O)(=O)N(C)CC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C16H15Cl3N2O3S/c1-10-6-7-11(17)8-14(10)25(23,24)21(2)9-15(22)20-16-12(18)4-3-5-13(16)19/h3-8H,9H2,1-2H3,(H,20,22)
InChIKeyUDDKQZUEQLNZBG-UHFFFAOYSA-N
MW421.73 g/mol
LogP4.21
Rot. Bonds5

About 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide

2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide (PubChem CID 34055922) has the molecular formula C16H15Cl3N2O3S and a molecular weight of 421.73 g/mol. Its IUPAC name is 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide
PubChem CID34055922
Molecular FormulaC16H15Cl3N2O3S
Molecular Weight421.73 g/mol
Exact Mass419.99
IUPAC Name2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide
SMILESCc1ccc(Cl)cc1S(=O)(=O)N(C)CC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C16H15Cl3N2O3S/c1-10-6-7-11(17)8-14(10)25(23,24)21(2)9-15(22)20-16-12(18)4-3-5-13(16)19/h3-8H,9H2,1-2H3,(H,20,22)
InChIKeyUDDKQZUEQLNZBG-UHFFFAOYSA-N
XLogP4.21
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.73
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide?
The IUPAC name of 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide (CID 34055922) is 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide.
What is the SMILES notation for 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide?
The canonical SMILES for 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide is Cc1ccc(Cl)cc1S(=O)(=O)N(C)CC(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide?
The InChIKey is UDDKQZUEQLNZBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl3N2O3S/c1-10-6-7-11(17)8-14(10)25(23,24)21(2)9-15(22)20-16-12(18)4-3-5-13(16)19/h3-8H,9H2,1-2H3,(H,20,22).
What are the key properties of 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide?
2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide has a molecular weight of 421.73 g/mol, XLogP of 4.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-2-methylphenyl)sulfonyl-methylamino]-N-(2,6-dichlorophenyl)acetamide is sourced from PubChem (CID 34055922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).