4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide

C11H13N3O4S2 — CID 6504157

IUPAC4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
SMILESCCNS(=O)(=O)c1csc(C(=O)Nc2cc(C)on2)c1
InChIInChI=1S/C11H13N3O4S2/c1-3-12-20(16,17)8-5-9(19-6-8)11(15)13-10-4-7(2)18-14-10/h4-6,12H,3H2,1-2H3,(H,13,14,15)
InChIKeyRJHVTTHLFKBEID-UHFFFAOYSA-N
MW315.38 g/mol
LogP1.60
Rot. Bonds5

About 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide

4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide (PubChem CID 6504157) has the molecular formula C11H13N3O4S2 and a molecular weight of 315.38 g/mol. Its IUPAC name is 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
PubChem CID6504157
Molecular FormulaC11H13N3O4S2
Molecular Weight315.38 g/mol
Exact Mass315.03
IUPAC Name4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide
SMILESCCNS(=O)(=O)c1csc(C(=O)Nc2cc(C)on2)c1
InChIInChI=1S/C11H13N3O4S2/c1-3-12-20(16,17)8-5-9(19-6-8)11(15)13-10-4-7(2)18-14-10/h4-6,12H,3H2,1-2H3,(H,13,14,15)
InChIKeyRJHVTTHLFKBEID-UHFFFAOYSA-N
XLogP1.60
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide?
The IUPAC name of 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide (CID 6504157) is 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide?
The canonical SMILES for 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide is CCNS(=O)(=O)c1csc(C(=O)Nc2cc(C)on2)c1.
What is the InChIKey of 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide?
The InChIKey is RJHVTTHLFKBEID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O4S2/c1-3-12-20(16,17)8-5-9(19-6-8)11(15)13-10-4-7(2)18-14-10/h4-6,12H,3H2,1-2H3,(H,13,14,15).
What are the key properties of 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide?
4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide has a molecular weight of 315.38 g/mol, XLogP of 1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylsulfamoyl)-N-(5-methyl-1,2-oxazol-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 6504157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).