2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide

C15H14ClNO4S — CID 1486366

IUPAC2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CS(=O)(=O)c2cccc(Cl)c2)cc1
InChIInChI=1S/C15H14ClNO4S/c1-21-13-7-5-12(6-8-13)17-15(18)10-22(19,20)14-4-2-3-11(16)9-14/h2-9H,10H2,1H3,(H,17,18)
InChIKeyNXCYBQJILDPVGC-UHFFFAOYSA-N
MW339.80 g/mol
LogP2.76
Rot. Bonds5

About 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide

2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide (PubChem CID 1486366) has the molecular formula C15H14ClNO4S and a molecular weight of 339.80 g/mol. Its IUPAC name is 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
PubChem CID1486366
Molecular FormulaC15H14ClNO4S
Molecular Weight339.80 g/mol
Exact Mass339.03
IUPAC Name2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CS(=O)(=O)c2cccc(Cl)c2)cc1
InChIInChI=1S/C15H14ClNO4S/c1-21-13-7-5-12(6-8-13)17-15(18)10-22(19,20)14-4-2-3-11(16)9-14/h2-9H,10H2,1H3,(H,17,18)
InChIKeyNXCYBQJILDPVGC-UHFFFAOYSA-N
XLogP2.76
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.80
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide
CID 27449078
2-(4-methoxyphenyl)sulfonyl-N-phenylacetamide
CID 15451751
N-(3,4-difluorophenyl)-2-(4-methoxyphenyl)sulfonylacetamide
CID 86992863
(2S)-2-[(3-chlorophenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 9042158
3-(3-chloro-N-methylsulfonylanilino)-N-(4-methoxyphenyl)propanamide
CID 113143839
N-(4-acetamidophenyl)-3-(3-chlorophenyl)sulfonylpropanamide
CID 110423914
N-(3-chlorophenyl)-2-[[2-[(4-methoxyphenyl)carbamoylamino]-2-oxoethyl]-methylamino]acetamide
CID 37128973
N-(4-bromophenyl)-2-(3-chloro-N-(4-methoxyphenyl)sulfonylanilino)acetamide
CID 126121109
1-(3-chlorophenyl)-3-(4-methoxyphenyl)urea
CID 727874
N-[4-(3-chloroanilino)phenyl]-2-(4-methoxyphenyl)acetamide
CID 112986980
2-(4-methoxyphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]acetamide
CID 1488181
2-(3-chlorophenyl)sulfonyl-1-(4-methoxyphenyl)ethanamine
CID 64674038

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide (CID 1486366) is 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)CS(=O)(=O)c2cccc(Cl)c2)cc1.
What is the InChIKey of 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide?
The InChIKey is NXCYBQJILDPVGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO4S/c1-21-13-7-5-12(6-8-13)17-15(18)10-22(19,20)14-4-2-3-11(16)9-14/h2-9H,10H2,1H3,(H,17,18).
What are the key properties of 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide?
2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide has a molecular weight of 339.80 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)sulfonyl-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 1486366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).