N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide

C17H20N2O4S2 — CID 6504124

IUPACN-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide
SMILESCc1ccccc1NC(=O)c1cc(S(=O)(=O)NCC2CCCO2)cs1
InChIInChI=1S/C17H20N2O4S2/c1-12-5-2-3-7-15(12)19-17(20)16-9-14(11-24-16)25(21,22)18-10-13-6-4-8-23-13/h2-3,5,7,9,11,13,18H,4,6,8,10H2,1H3,(H,19,20)
InChIKeyQQSFQGFKUAMMMF-UHFFFAOYSA-N
MW380.49 g/mol
LogP2.77
Rot. Bonds6

About N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide

N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide (PubChem CID 6504124) has the molecular formula C17H20N2O4S2 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide
PubChem CID6504124
Molecular FormulaC17H20N2O4S2
Molecular Weight380.49 g/mol
Exact Mass380.09
IUPAC NameN-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide
SMILESCc1ccccc1NC(=O)c1cc(S(=O)(=O)NCC2CCCO2)cs1
InChIInChI=1S/C17H20N2O4S2/c1-12-5-2-3-7-15(12)19-17(20)16-9-14(11-24-16)25(21,22)18-10-13-6-4-8-23-13/h2-3,5,7,9,11,13,18H,4,6,8,10H2,1H3,(H,19,20)
InChIKeyQQSFQGFKUAMMMF-UHFFFAOYSA-N
XLogP2.77
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(cyclopentylsulfamoyl)-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6504119
N-(2-methylphenyl)-4-(propan-2-ylsulfamoyl)thiophene-2-carboxamide
CID 6504111
N-(2-ethylphenyl)-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
CID 1428385
N-(2,4-dimethylphenyl)-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
CID 1428381
4-[(4-hydroxyphenyl)sulfamoyl]-N-(2-methylphenyl)thiophene-2-carboxamide
CID 6504088
N-(2,6-dimethylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 109060029
N-(2-chlorophenyl)-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
CID 1428408
4-[benzyl(methyl)sulfamoyl]-N-(oxolan-2-ylmethyl)thiophene-2-carboxamide
CID 6503608
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)-6-(oxolan-2-ylmethylamino)pyridazine-3-carboxamide
CID 109114870
N-tert-butyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 109063903

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide (CID 6504124) is N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide is Cc1ccccc1NC(=O)c1cc(S(=O)(=O)NCC2CCCO2)cs1.
What is the InChIKey of N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide?
The InChIKey is QQSFQGFKUAMMMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S2/c1-12-5-2-3-7-15(12)19-17(20)16-9-14(11-24-16)25(21,22)18-10-13-6-4-8-23-13/h2-3,5,7,9,11,13,18H,4,6,8,10H2,1H3,(H,19,20).
What are the key properties of N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide?
N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)thiophene-2-carboxamide is sourced from PubChem (CID 6504124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).