N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide

C13H14N2O3S2 — CID 9140832

IUPACN-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide
SMILESCc1ccc(NC(=O)Cc2cccs2)cc1S(N)(=O)=O
InChIInChI=1S/C13H14N2O3S2/c1-9-4-5-10(7-12(9)20(14,17)18)15-13(16)8-11-3-2-6-19-11/h2-7H,8H2,1H3,(H,15,16)(H2,14,17,18)
InChIKeyZKHSPHNNTGZIIK-UHFFFAOYSA-N
MW310.40 g/mol
LogP1.89
Rot. Bonds4

About N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide

N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide (PubChem CID 9140832) has the molecular formula C13H14N2O3S2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide
PubChem CID9140832
Molecular FormulaC13H14N2O3S2
Molecular Weight310.40 g/mol
Exact Mass310.04
IUPAC NameN-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide
SMILESCc1ccc(NC(=O)Cc2cccs2)cc1S(N)(=O)=O
InChIInChI=1S/C13H14N2O3S2/c1-9-4-5-10(7-12(9)20(14,17)18)15-13(16)8-11-3-2-6-19-11/h2-7H,8H2,1H3,(H,15,16)(H2,14,17,18)
InChIKeyZKHSPHNNTGZIIK-UHFFFAOYSA-N
XLogP1.89
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-thiophen-2-ylacetamide
CID 4303625
N-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methylphenyl]-2-thiophen-2-ylacetamide
CID 7908243
N-[4-methyl-3-(trifluoromethyl)phenyl]-2-thiophen-2-ylacetamide
CID 24632484
2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 18277249
[2-(3,4-dimethylanilino)-2-oxoethyl] 2-thiophen-2-ylacetate
CID 7799163
N-[4-methyl-3-(thiophen-2-ylmethylsulfamoyl)phenyl]acetamide
CID 39792806
N-(4-methyl-3-sulfamoylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 18159552
2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 9140853
3,3,3-trifluoro-N-(4-methyl-3-sulfamoylphenyl)propanamide
CID 47155694
N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide
CID 9141000
3-(benzenesulfonamido)-N-(4-methyl-3-sulfamoylphenyl)propanamide
CID 18268034
N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-[methyl(thiophen-2-ylmethyl)amino]acetamide
CID 8965560

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide (CID 9140832) is N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide is Cc1ccc(NC(=O)Cc2cccs2)cc1S(N)(=O)=O.
What is the InChIKey of N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide?
The InChIKey is ZKHSPHNNTGZIIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S2/c1-9-4-5-10(7-12(9)20(14,17)18)15-13(16)8-11-3-2-6-19-11/h2-7H,8H2,1H3,(H,15,16)(H2,14,17,18).
What are the key properties of N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide?
N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide has a molecular weight of 310.40 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 9140832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).