5-formylthiophene-2-sulfonamide

C5H5NO3S2 — CID 83483945

IUPAC5-formylthiophene-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(C=O)s1
InChIInChI=1S/C5H5NO3S2/c6-11(8,9)5-2-1-4(3-7)10-5/h1-3H,(H2,6,8,9)
InChIKeyYIWSNLGWHOCGMY-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.21
Rot. Bonds2

About 5-formylthiophene-2-sulfonamide

5-formylthiophene-2-sulfonamide (PubChem CID 83483945) has the molecular formula C5H5NO3S2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 5-formylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-formylthiophene-2-sulfonamide
PubChem CID83483945
Molecular FormulaC5H5NO3S2
Molecular Weight191.23 g/mol
Exact Mass190.97
IUPAC Name5-formylthiophene-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(C=O)s1
InChIInChI=1S/C5H5NO3S2/c6-11(8,9)5-2-1-4(3-7)10-5/h1-3H,(H2,6,8,9)
InChIKeyYIWSNLGWHOCGMY-UHFFFAOYSA-N
XLogP0.21
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-formylthiophene-2-sulfonamide?
The IUPAC name of 5-formylthiophene-2-sulfonamide (CID 83483945) is 5-formylthiophene-2-sulfonamide.
What is the SMILES notation for 5-formylthiophene-2-sulfonamide?
The canonical SMILES for 5-formylthiophene-2-sulfonamide is NS(=O)(=O)c1ccc(C=O)s1.
What is the InChIKey of 5-formylthiophene-2-sulfonamide?
The InChIKey is YIWSNLGWHOCGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5NO3S2/c6-11(8,9)5-2-1-4(3-7)10-5/h1-3H,(H2,6,8,9).
What are the key properties of 5-formylthiophene-2-sulfonamide?
5-formylthiophene-2-sulfonamide has a molecular weight of 191.23 g/mol, XLogP of 0.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-formylthiophene-2-sulfonamide is sourced from PubChem (CID 83483945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).