3-methyl-5-sulfamoylthiophene-2-carboxamide

C6H8N2O3S2 — CID 130619284

IUPAC3-methyl-5-sulfamoylthiophene-2-carboxamide
SMILESCc1cc(S(N)(=O)=O)sc1C(N)=O
InChIInChI=1S/C6H8N2O3S2/c1-3-2-4(13(8,10)11)12-5(3)6(7)9/h2H,1H3,(H2,7,9)(H2,8,10,11)
InChIKeyIZKKLRFQLABKBE-UHFFFAOYSA-N
MW220.27 g/mol
LogP-0.20
Rot. Bonds2

About 3-methyl-5-sulfamoylthiophene-2-carboxamide

3-methyl-5-sulfamoylthiophene-2-carboxamide (PubChem CID 130619284) has the molecular formula C6H8N2O3S2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 3-methyl-5-sulfamoylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-methyl-5-sulfamoylthiophene-2-carboxamide
PubChem CID130619284
Molecular FormulaC6H8N2O3S2
Molecular Weight220.27 g/mol
Exact Mass220.00
IUPAC Name3-methyl-5-sulfamoylthiophene-2-carboxamide
SMILESCc1cc(S(N)(=O)=O)sc1C(N)=O
InChIInChI=1S/C6H8N2O3S2/c1-3-2-4(13(8,10)11)12-5(3)6(7)9/h2H,1H3,(H2,7,9)(H2,8,10,11)
InChIKeyIZKKLRFQLABKBE-UHFFFAOYSA-N
XLogP-0.20
TPSA103.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-sulfamoylthiophene-2-carboxamide?
The IUPAC name of 3-methyl-5-sulfamoylthiophene-2-carboxamide (CID 130619284) is 3-methyl-5-sulfamoylthiophene-2-carboxamide.
What is the SMILES notation for 3-methyl-5-sulfamoylthiophene-2-carboxamide?
The canonical SMILES for 3-methyl-5-sulfamoylthiophene-2-carboxamide is Cc1cc(S(N)(=O)=O)sc1C(N)=O.
What is the InChIKey of 3-methyl-5-sulfamoylthiophene-2-carboxamide?
The InChIKey is IZKKLRFQLABKBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3S2/c1-3-2-4(13(8,10)11)12-5(3)6(7)9/h2H,1H3,(H2,7,9)(H2,8,10,11).
What are the key properties of 3-methyl-5-sulfamoylthiophene-2-carboxamide?
3-methyl-5-sulfamoylthiophene-2-carboxamide has a molecular weight of 220.27 g/mol, XLogP of -0.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-sulfamoylthiophene-2-carboxamide is sourced from PubChem (CID 130619284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).