3-(hydroxymethyl)thiophene-2-sulfonamide

C5H7NO3S2 — CID 10821609

IUPAC3-(hydroxymethyl)thiophene-2-sulfonamide
SMILESNS(=O)(=O)c1sccc1CO
InChIInChI=1S/C5H7NO3S2/c6-11(8,9)5-4(3-7)1-2-10-5/h1-2,7H,3H2,(H2,6,8,9)
InChIKeyRDKPEFSKRKCMPB-UHFFFAOYSA-N
MW193.25 g/mol
LogP-0.11
Rot. Bonds2

About 3-(hydroxymethyl)thiophene-2-sulfonamide

3-(hydroxymethyl)thiophene-2-sulfonamide (PubChem CID 10821609) has the molecular formula C5H7NO3S2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-(hydroxymethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name3-(hydroxymethyl)thiophene-2-sulfonamide
PubChem CID10821609
Molecular FormulaC5H7NO3S2
Molecular Weight193.25 g/mol
Exact Mass192.99
IUPAC Name3-(hydroxymethyl)thiophene-2-sulfonamide
SMILESNS(=O)(=O)c1sccc1CO
InChIInChI=1S/C5H7NO3S2/c6-11(8,9)5-4(3-7)1-2-10-5/h1-2,7H,3H2,(H2,6,8,9)
InChIKeyRDKPEFSKRKCMPB-UHFFFAOYSA-N
XLogP-0.11
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(hydroxymethyl)thiophene-2-sulfonamide?
The IUPAC name of 3-(hydroxymethyl)thiophene-2-sulfonamide (CID 10821609) is 3-(hydroxymethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 3-(hydroxymethyl)thiophene-2-sulfonamide?
The canonical SMILES for 3-(hydroxymethyl)thiophene-2-sulfonamide is NS(=O)(=O)c1sccc1CO.
What is the InChIKey of 3-(hydroxymethyl)thiophene-2-sulfonamide?
The InChIKey is RDKPEFSKRKCMPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO3S2/c6-11(8,9)5-4(3-7)1-2-10-5/h1-2,7H,3H2,(H2,6,8,9).
What are the key properties of 3-(hydroxymethyl)thiophene-2-sulfonamide?
3-(hydroxymethyl)thiophene-2-sulfonamide has a molecular weight of 193.25 g/mol, XLogP of -0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydroxymethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 10821609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).