5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide

C17H20N2O4S2 — CID 9074206

IUPAC5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)c2ccc(C(C)=O)s2)cc1
InChIInChI=1S/C17H20N2O4S2/c1-4-19(5-2)25(22,23)14-8-6-13(7-9-14)18-17(21)16-11-10-15(24-16)12(3)20/h6-11H,4-5H2,1-3H3,(H,18,21)
InChIKeyGOYIAJNDIYEQHH-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.23
Rot. Bonds7

About 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide

5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide (PubChem CID 9074206) has the molecular formula C17H20N2O4S2 and a molecular weight of 380.49 g/mol. Its IUPAC name is 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide
PubChem CID9074206
Molecular FormulaC17H20N2O4S2
Molecular Weight380.49 g/mol
Exact Mass380.09
IUPAC Name5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)c2ccc(C(C)=O)s2)cc1
InChIInChI=1S/C17H20N2O4S2/c1-4-19(5-2)25(22,23)14-8-6-13(7-9-14)18-17(21)16-11-10-15(24-16)12(3)20/h6-11H,4-5H2,1-3H3,(H,18,21)
InChIKeyGOYIAJNDIYEQHH-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-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
N-(4-acetamidophenyl)-4-(diethylsulfamoyl)benzamide
CID 7940158
N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 730591
N-(4-acetylphenyl)-4-(diethylsulfamoyl)thiophene-2-carboxamide
CID 6503218
4-acetyl-N-[4-(diethylsulfamoyl)phenyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
CID 9415910
4-[[4-(diethylsulfamoyl)benzoyl]amino]-N,N-dimethylbenzamide
CID 8698718
2-bromo-N-[4-(diethylsulfamoyl)phenyl]acetamide
CID 46736589
N-[4-[ethyl(2-hydroxyethyl)sulfamoyl]phenyl]acetamide
CID 39387601
5-acetamido-N-[[4-(diethylsulfamoyl)phenyl]methyl]thiophene-2-carboxamide
CID 24610904
2-bromo-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 1303320
N-tert-butyl-4-[[4-(diethylsulfamoyl)benzoyl]amino]benzamide
CID 38253660
N-[4-(diethylsulfamoyl)phenyl]-4-methylthiadiazole-5-carboxamide
CID 9074136

Frequently Asked Questions

What is the IUPAC name of 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide?
The IUPAC name of 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide (CID 9074206) is 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2ccc(C(C)=O)s2)cc1.
What is the InChIKey of 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide?
The InChIKey is GOYIAJNDIYEQHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S2/c1-4-19(5-2)25(22,23)14-8-6-13(7-9-14)18-17(21)16-11-10-15(24-16)12(3)20/h6-11H,4-5H2,1-3H3,(H,18,21).
What are the key properties of 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide?
5-acetyl-N-[4-(diethylsulfamoyl)phenyl]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 5-acetyl-N-[4-(diethylsulfamoyl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 9074206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).