5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide

C12H14N2O4S2 — CID 114822706

IUPAC5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide
SMILESCc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)s2)co1
InChIInChI=1S/C12H14N2O4S2/c1-8-6-9(7-18-8)12(15)14-5-4-10-2-3-11(19-10)20(13,16)17/h2-3,6-7H,4-5H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyWVESPJSJWJXOIJ-UHFFFAOYSA-N
MW314.39 g/mol
LogP1.27
Rot. Bonds5

About 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide

5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide (PubChem CID 114822706) has the molecular formula C12H14N2O4S2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide
PubChem CID114822706
Molecular FormulaC12H14N2O4S2
Molecular Weight314.39 g/mol
Exact Mass314.04
IUPAC Name5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide
SMILESCc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)s2)co1
InChIInChI=1S/C12H14N2O4S2/c1-8-6-9(7-18-8)12(15)14-5-4-10-2-3-11(19-10)20(13,16)17/h2-3,6-7H,4-5H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyWVESPJSJWJXOIJ-UHFFFAOYSA-N
XLogP1.27
TPSA102.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
CID 43246441
4-hydroxy-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
CID 61128277
4-iodo-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]benzamide
CID 43246453
1,5-dimethyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrole-2-carboxamide
CID 60976637
2,4-dimethyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]-1,3-oxazole-5-carboxamide
CID 79884277
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]butanamide
CID 43133898
2-oxo-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]-1,3-dihydroimidazole-4-carboxamide
CID 61129579
3-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]but-2-enamide
CID 61128280
2-acetamido-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]acetamide
CID 61128464
3-bromo-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]thiophene-2-carboxamide
CID 47286704
3-bromo-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyridine-2-carboxamide
CID 107519551
N-[2-(5-sulfamoylthiophen-2-yl)ethyl]pyrrolidine-1-carboxamide
CID 113224273

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide?
The IUPAC name of 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide (CID 114822706) is 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide?
The canonical SMILES for 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide is Cc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)s2)co1.
What is the InChIKey of 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide?
The InChIKey is WVESPJSJWJXOIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O4S2/c1-8-6-9(7-18-8)12(15)14-5-4-10-2-3-11(19-10)20(13,16)17/h2-3,6-7H,4-5H2,1H3,(H,14,15)(H2,13,16,17).
What are the key properties of 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide?
5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide has a molecular weight of 314.39 g/mol, XLogP of 1.27, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-3-carboxamide is sourced from PubChem (CID 114822706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).