N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide

C12H11ClN2O3S2 — CID 44520898

IUPACN-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide
SMILESNS(=O)(=O)c1ccc(NC(=O)Cc2cccs2)c(Cl)c1
InChIInChI=1S/C12H11ClN2O3S2/c13-10-7-9(20(14,17)18)3-4-11(10)15-12(16)6-8-2-1-5-19-8/h1-5,7H,6H2,(H,15,16)(H2,14,17,18)
InChIKeyXYVXWJDWSLYIMU-UHFFFAOYSA-N
MW330.82 g/mol
LogP2.23
Rot. Bonds4

About N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide

N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide (PubChem CID 44520898) has the molecular formula C12H11ClN2O3S2 and a molecular weight of 330.82 g/mol. Its IUPAC name is N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide
PubChem CID44520898
Molecular FormulaC12H11ClN2O3S2
Molecular Weight330.82 g/mol
Exact Mass329.99
IUPAC NameN-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide
SMILESNS(=O)(=O)c1ccc(NC(=O)Cc2cccs2)c(Cl)c1
InChIInChI=1S/C12H11ClN2O3S2/c13-10-7-9(20(14,17)18)3-4-11(10)15-12(16)6-8-2-1-5-19-8/h1-5,7H,6H2,(H,15,16)(H2,14,17,18)
InChIKeyXYVXWJDWSLYIMU-UHFFFAOYSA-N
XLogP2.23
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-sulfamoylphenyl)-2-(thiophen-2-yl)acetamide
CID 670143
N-(2-chlorophenyl)thiophene-2-carboxamide
CID 652985
N-(4-sulfamoylphenyl)thiophene-2-carboxamide
CID 687455
N-(2-chloro-4-sulfamoylphenyl)-3-sulfanylpropanamide
CID 23645367
N-(2-Fluoro-4-Sulfamoylphenyl)-2-(Thiophen-2-Yl)acetamide
CID 44520897
N-(2-chloro-4-{[(1,1-dioxotetrahydro-1H-1lambda~6~-thiophen-3-yl)amino]sulfonyl}phenyl)acetamide
CID 2810894
N-(4-chlorophenyl)-2-(thiophen-2-yl)acetamide
CID 669817
N-[4-(dipropylsulfamoyl)phenyl]-2-thiophen-2-ylacetamide
CID 2931351
N-(2-chloro-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
CID 4882743
N-(2-chloro-5-methylsulfonylphenyl)-2-thiophen-3-ylacetamide
CID 24241482
N-(4-(N-(2-chlorophenyl)sulfamoyl)phenyl)thiophene-3-carboxamide
CID 49865398
N-(4-{[(5-chloro-2-thienyl)sulfonyl]amino}phenyl)acetamide
CID 893603

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide (CID 44520898) is N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide is NS(=O)(=O)c1ccc(NC(=O)Cc2cccs2)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide?
The InChIKey is XYVXWJDWSLYIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O3S2/c13-10-7-9(20(14,17)18)3-4-11(10)15-12(16)6-8-2-1-5-19-8/h1-5,7H,6H2,(H,15,16)(H2,14,17,18).
What are the key properties of N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide?
N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide has a molecular weight of 330.82 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-sulfamoylphenyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 44520898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).