N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide

C15H18N2O3S2 — CID 58962527

IUPACN-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCCc2cccs2)cc1C
InChIInChI=1S/C15H18N2O3S2/c1-11-10-14(5-6-15(11)17-12(2)18)22(19,20)16-8-7-13-4-3-9-21-13/h3-6,9-10,16H,7-8H2,1-2H3,(H,17,18)
InChIKeyOGPXMCYSKRMNPB-UHFFFAOYSA-N
MW338.45 g/mol
LogP2.54
Rot. Bonds6

About N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide

N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide (PubChem CID 58962527) has the molecular formula C15H18N2O3S2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide
PubChem CID58962527
Molecular FormulaC15H18N2O3S2
Molecular Weight338.45 g/mol
Exact Mass338.08
IUPAC NameN-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCCc2cccs2)cc1C
InChIInChI=1S/C15H18N2O3S2/c1-11-10-14(5-6-15(11)17-12(2)18)22(19,20)16-8-7-13-4-3-9-21-13/h3-6,9-10,16H,7-8H2,1-2H3,(H,17,18)
InChIKeyOGPXMCYSKRMNPB-UHFFFAOYSA-N
XLogP2.54
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(2-hydroxyethylsulfamoyl)-2-methylphenyl]acetamide
CID 58962606
4-(2,5-dioxopyrrolidin-1-yl)-3-methyl-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 43853598
3-bromo-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 3793268
4-propyl-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 3793246
4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid
CID 61072796
1,3-dimethyl-2-oxo-N-(2-thiophen-2-ylethyl)benzimidazole-5-sulfonamide
CID 49454127
4-amino-2,6-dimethyl-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 79588588
2-methyl-5-(thiophen-2-ylmethylsulfamoyl)benzoic acid
CID 2447471
4-(aminomethyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 18801910
2-(methylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-sulfonamide
CID 62145049
N-(4-chloro-2-methylphenyl)-3-(thiophen-2-ylmethylsulfamoyl)benzamide
CID 26717987
5-bromo-4-methyl-N-(2-thiophen-2-ylethyl)thiophene-2-sulfonamide
CID 79931997

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide?
The IUPAC name of N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide (CID 58962527) is N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide?
The canonical SMILES for N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)NCCc2cccs2)cc1C.
What is the InChIKey of N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide?
The InChIKey is OGPXMCYSKRMNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S2/c1-11-10-14(5-6-15(11)17-12(2)18)22(19,20)16-8-7-13-4-3-9-21-13/h3-6,9-10,16H,7-8H2,1-2H3,(H,17,18).
What are the key properties of N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide?
N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide has a molecular weight of 338.45 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-4-(2-thiophen-2-ylethylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 58962527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).