N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide

C19H18N2O3S2 — CID 6504099

IUPACN-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide
SMILESCc1cccc(NS(=O)(=O)c2csc(C(=O)Nc3ccccc3C)c2)c1
InChIInChI=1S/C19H18N2O3S2/c1-13-6-5-8-15(10-13)21-26(23,24)16-11-18(25-12-16)19(22)20-17-9-4-3-7-14(17)2/h3-12,21H,1-2H3,(H,20,22)
InChIKeyIABJTAVPSNDCJB-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.42
Rot. Bonds5

About N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide

N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide (PubChem CID 6504099) has the molecular formula C19H18N2O3S2 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide
PubChem CID6504099
Molecular FormulaC19H18N2O3S2
Molecular Weight386.50 g/mol
Exact Mass386.08
IUPAC NameN-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide
SMILESCc1cccc(NS(=O)(=O)c2csc(C(=O)Nc3ccccc3C)c2)c1
InChIInChI=1S/C19H18N2O3S2/c1-13-6-5-8-15(10-13)21-26(23,24)16-11-18(25-12-16)19(22)20-17-9-4-3-7-14(17)2/h3-12,21H,1-2H3,(H,20,22)
InChIKeyIABJTAVPSNDCJB-UHFFFAOYSA-N
XLogP4.42
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-hydroxyphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6504088
N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide
CID 6504111
4-(cyclopentylsulfamoyl)-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6504119
4-[methyl-(3-methylphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6503694
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
ethane;4-methyl-N-(2-methylphenyl)-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 142804944
3-(benzenesulfonamido)-N-(2-methylphenyl)benzamide
CID 9341944
N-(2,3-dimethylphenyl)-4-[(3-methylphenyl)sulfamoyl]benzamide
CID 109061685
4,5-dimethoxy-2-[[4-[(2-methylphenyl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid
CID 22307958
3-[(4-bromophenyl)sulfonylamino]-N-(2-methylphenyl)benzamide
CID 26538067
N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide
CID 6504124

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide?
The IUPAC name of N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide (CID 6504099) is N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide is Cc1cccc(NS(=O)(=O)c2csc(C(=O)Nc3ccccc3C)c2)c1.
What is the InChIKey of N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide?
The InChIKey is IABJTAVPSNDCJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3S2/c1-13-6-5-8-15(10-13)21-26(23,24)16-11-18(25-12-16)19(22)20-17-9-4-3-7-14(17)2/h3-12,21H,1-2H3,(H,20,22).
What are the key properties of N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide?
N-(2-methylphenyl)-4-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide has a molecular weight of 386.50 g/mol, XLogP of 4.42, 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-[(3-methylphenyl)sulfamoyl]thiophene-2-carboxamide is sourced from PubChem (CID 6504099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).