N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide

C15H18N2O3S2 — CID 6504111

IUPACN-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide
SMILESCc1ccccc1NC(=O)c1cc(S(=O)(=O)NC(C)C)cs1
InChIInChI=1S/C15H18N2O3S2/c1-10(2)17-22(19,20)12-8-14(21-9-12)15(18)16-13-7-5-4-6-11(13)3/h4-10,17H,1-3H3,(H,16,18)
InChIKeyZKGICDGANFPHJQ-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.00
Rot. Bonds5

About N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide

N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide (PubChem CID 6504111) has the molecular formula C15H18N2O3S2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide
PubChem CID6504111
Molecular FormulaC15H18N2O3S2
Molecular Weight338.45 g/mol
Exact Mass338.08
IUPAC NameN-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide
SMILESCc1ccccc1NC(=O)c1cc(S(=O)(=O)NC(C)C)cs1
InChIInChI=1S/C15H18N2O3S2/c1-10(2)17-22(19,20)12-8-14(21-9-12)15(18)16-13-7-5-4-6-11(13)3/h4-10,17H,1-3H3,(H,16,18)
InChIKeyZKGICDGANFPHJQ-UHFFFAOYSA-N
XLogP3.00
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[4-(propan-2-ylsulfamoyl)thiophene-2-carbonyl]amino]benzoic acid
CID 6504079
4-(cyclopentylsulfamoyl)-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6504119
4-[(4-hydroxyphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6504088
N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide
CID 6504099
4-methyl-3-[[4-[(2-methylphenyl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid
CID 22307959
4-(dimethylsulfamoyl)-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6503064
N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide
CID 6504124
4,5-dimethoxy-2-[[4-[(2-methylphenyl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid
CID 22307958
2-[[5-(phenylcarbamoyl)thiophen-3-yl]sulfonylamino]propanoic acid
CID 6504034
4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6503694
N-(2-methylphenyl)-4-(3-methylpiperidin-1-yl)sulfonylthiophene-2-carboxamide
CID 6503536
N-(2,3-dimethylphenyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 26538375

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide (CID 6504111) is N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide is Cc1ccccc1NC(=O)c1cc(S(=O)(=O)NC(C)C)cs1.
What is the InChIKey of N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide?
The InChIKey is ZKGICDGANFPHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S2/c1-10(2)17-22(19,20)12-8-14(21-9-12)15(18)16-13-7-5-4-6-11(13)3/h4-10,17H,1-3H3,(H,16,18).
What are the key properties of N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide?
N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide has a molecular weight of 338.45 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide is sourced from PubChem (CID 6504111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).