N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide

C16H15Cl2NO4S — CID 41324012

IUPACN-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide
SMILESCOc1ccc(S(=O)(=O)CCC(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C16H15Cl2NO4S/c1-23-11-5-7-12(8-6-11)24(21,22)10-9-15(20)19-14-4-2-3-13(17)16(14)18/h2-8H,9-10H2,1H3,(H,19,20)
InChIKeyWZEUCWOPLYGVBU-UHFFFAOYSA-N
MW388.27 g/mol
LogP3.80
Rot. Bonds6

About N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide

N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide (PubChem CID 41324012) has the molecular formula C16H15Cl2NO4S and a molecular weight of 388.27 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide
PubChem CID41324012
Molecular FormulaC16H15Cl2NO4S
Molecular Weight388.27 g/mol
Exact Mass387.01
IUPAC NameN-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide
SMILESCOc1ccc(S(=O)(=O)CCC(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C16H15Cl2NO4S/c1-23-11-5-7-12(8-6-11)24(21,22)10-9-15(20)19-14-4-2-3-13(17)16(14)18/h2-8H,9-10H2,1H3,(H,19,20)
InChIKeyWZEUCWOPLYGVBU-UHFFFAOYSA-N
XLogP3.80
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.27
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyanophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide
CID 41323836
N-(2,3-dichlorophenyl)-5-(4-methoxyphenyl)-5-oxopentanamide
CID 110298279
3-(4-acetamidophenyl)sulfonyl-N-(2-chlorophenyl)propanamide
CID 110420476
2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-(2,3-dichlorophenyl)acetamide
CID 21372845
N-(3-acetylphenyl)-3-(4-methoxyphenyl)sulfonylpropanamide
CID 4112435
N-(4-bromo-2-methylphenyl)-3-(4-methoxyphenyl)sulfonylpropanamide
CID 3360808
N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(4-methoxyphenyl)sulfonylpropanamide
CID 4301032
N-benzhydryl-3-(4-methoxyphenyl)sulfonylpropanamide
CID 4117512
N-(2,3-dichlorophenyl)-3-piperidin-1-ylsulfonylpropanamide
CID 110342707
3-(4-methoxyphenyl)sulfonyl-N-(3-nitrophenyl)propanamide
CID 4307145
N-(3-chloro-2-pyrazol-1-ylphenyl)-3-(4-methylphenyl)sulfonylpropanamide
CID 78891540
(3R)-3-[benzenesulfonyl(methyl)amino]-N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)propanamide
CID 92647962

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide?
The IUPAC name of N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide (CID 41324012) is N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide is COc1ccc(S(=O)(=O)CCC(=O)Nc2cccc(Cl)c2Cl)cc1.
What is the InChIKey of N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide?
The InChIKey is WZEUCWOPLYGVBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO4S/c1-23-11-5-7-12(8-6-11)24(21,22)10-9-15(20)19-14-4-2-3-13(17)16(14)18/h2-8H,9-10H2,1H3,(H,19,20).
What are the key properties of N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide?
N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide has a molecular weight of 388.27 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-3-(4-methoxyphenyl)sulfonylpropanamide is sourced from PubChem (CID 41324012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).