N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide

C17H20N2O4S2 — CID 6503218

IUPACN-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1csc(C(=O)Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C17H20N2O4S2/c1-4-19(5-2)25(22,23)15-10-16(24-11-15)17(21)18-14-8-6-13(7-9-14)12(3)20/h6-11H,4-5H2,1-3H3,(H,18,21)
InChIKeyLHCCTOQOEMTFTQ-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.23
Rot. Bonds7

About N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide

N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide (PubChem CID 6503218) has the molecular formula C17H20N2O4S2 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide
PubChem CID6503218
Molecular FormulaC17H20N2O4S2
Molecular Weight380.49 g/mol
Exact Mass380.09
IUPAC NameN-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1csc(C(=O)Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C17H20N2O4S2/c1-4-19(5-2)25(22,23)15-10-16(24-11-15)17(21)18-14-8-6-13(7-9-14)12(3)20/h6-11H,4-5H2,1-3H3,(H,18,21)
InChIKeyLHCCTOQOEMTFTQ-UHFFFAOYSA-N
XLogP3.23
TPSA83.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(diethylsulfamoyl)-N-(2-hydroxyphenyl)thiophene-2-carboxamide
CID 6503203
ethyl 4-[[4-[ethyl(methyl)sulfamoyl]thiophene-2-carbonyl]amino]benzoate
CID 6503175
4-(diethylsulfamoyl)-N-[3-(trifluoromethyl)phenyl]thiophene-2-carboxamide
CID 6503209
5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide
CID 9074206
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
4-(diethylsulfamoyl)-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 6503193
N-(4-acetamidophenyl)-4-(diethylsulfamoyl)benzamide
CID 7940158
2-[[4-(diethylsulfamoyl)thiophene-2-carbonyl]amino]benzoate
CID 6968672
4-(diethylsulfamoyl)thiophene-2-carboxylic acid
CID 27243111
4-(diethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
CID 6503197
4-(diethylsulfamoyl)-N-(2-nitrophenyl)thiophene-2-carboxamide
CID 2907877
4-acetamido-N-[3-(diethylsulfamoyl)phenyl]benzamide
CID 7760016

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide (CID 6503218) is N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide is CCN(CC)S(=O)(=O)c1csc(C(=O)Nc2ccc(C(C)=O)cc2)c1.
What is the InChIKey of N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide?
The InChIKey is LHCCTOQOEMTFTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S2/c1-4-19(5-2)25(22,23)15-10-16(24-11-15)17(21)18-14-8-6-13(7-9-14)12(3)20/h6-11H,4-5H2,1-3H3,(H,18,21).
What are the key properties of N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide?
N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 3.23, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide is sourced from PubChem (CID 6503218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).