4-(1-hydroxyethyl)thiophene-2-sulfonamide

C6H9NO3S2 — CID 10013252

IUPAC4-(1-hydroxyethyl)thiophene-2-sulfonamide
SMILESCC(O)c1csc(S(N)(=O)=O)c1
InChIInChI=1S/C6H9NO3S2/c1-4(8)5-2-6(11-3-5)12(7,9)10/h2-4,8H,1H3,(H2,7,9,10)
InChIKeyJRDLQEHEJMOZQF-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.45
Rot. Bonds2

About 4-(1-hydroxyethyl)thiophene-2-sulfonamide

4-(1-hydroxyethyl)thiophene-2-sulfonamide (PubChem CID 10013252) has the molecular formula C6H9NO3S2 and a molecular weight of 207.28 g/mol. Its IUPAC name is 4-(1-hydroxyethyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-(1-hydroxyethyl)thiophene-2-sulfonamide
PubChem CID10013252
Molecular FormulaC6H9NO3S2
Molecular Weight207.28 g/mol
Exact Mass207.00
IUPAC Name4-(1-hydroxyethyl)thiophene-2-sulfonamide
SMILESCC(O)c1csc(S(N)(=O)=O)c1
InChIInChI=1S/C6H9NO3S2/c1-4(8)5-2-6(11-3-5)12(7,9)10/h2-4,8H,1H3,(H2,7,9,10)
InChIKeyJRDLQEHEJMOZQF-UHFFFAOYSA-N
XLogP0.45
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxyethyl)thiophene-2-sulfonamide?
The IUPAC name of 4-(1-hydroxyethyl)thiophene-2-sulfonamide (CID 10013252) is 4-(1-hydroxyethyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-(1-hydroxyethyl)thiophene-2-sulfonamide?
The canonical SMILES for 4-(1-hydroxyethyl)thiophene-2-sulfonamide is CC(O)c1csc(S(N)(=O)=O)c1.
What is the InChIKey of 4-(1-hydroxyethyl)thiophene-2-sulfonamide?
The InChIKey is JRDLQEHEJMOZQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO3S2/c1-4(8)5-2-6(11-3-5)12(7,9)10/h2-4,8H,1H3,(H2,7,9,10).
What are the key properties of 4-(1-hydroxyethyl)thiophene-2-sulfonamide?
4-(1-hydroxyethyl)thiophene-2-sulfonamide has a molecular weight of 207.28 g/mol, XLogP of 0.45, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxyethyl)thiophene-2-sulfonamide is sourced from PubChem (CID 10013252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).