2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide

C17H18Cl2N2O3S — CID 15945383

IUPAC2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide
SMILESCc1ccc(NC(=O)Cc2c(Cl)cccc2Cl)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C17H18Cl2N2O3S/c1-11-7-8-12(9-16(11)25(23,24)21(2)3)20-17(22)10-13-14(18)5-4-6-15(13)19/h4-9H,10H2,1-3H3,(H,20,22)
InChIKeyUICXMQABNRIGRG-UHFFFAOYSA-N
MW401.32 g/mol
LogP3.73
Rot. Bonds5

About 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide

2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide (PubChem CID 15945383) has the molecular formula C17H18Cl2N2O3S and a molecular weight of 401.32 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide
PubChem CID15945383
Molecular FormulaC17H18Cl2N2O3S
Molecular Weight401.32 g/mol
Exact Mass400.04
IUPAC Name2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide
SMILESCc1ccc(NC(=O)Cc2c(Cl)cccc2Cl)cc1S(=O)(=O)N(C)C
InChIInChI=1S/C17H18Cl2N2O3S/c1-11-7-8-12(9-16(11)25(23,24)21(2)3)20-17(22)10-13-14(18)5-4-6-15(13)19/h4-9H,10H2,1-3H3,(H,20,22)
InChIKeyUICXMQABNRIGRG-UHFFFAOYSA-N
XLogP3.73
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.32
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide (CID 15945383) is 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide is Cc1ccc(NC(=O)Cc2c(Cl)cccc2Cl)cc1S(=O)(=O)N(C)C.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide?
The InChIKey is UICXMQABNRIGRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2O3S/c1-11-7-8-12(9-16(11)25(23,24)21(2)3)20-17(22)10-13-14(18)5-4-6-15(13)19/h4-9H,10H2,1-3H3,(H,20,22).
What are the key properties of 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide?
2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide has a molecular weight of 401.32 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-N-[3-(dimethylsulfamoyl)-4-methylphenyl]acetamide is sourced from PubChem (CID 15945383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).