3-hydroxybenzenesulfonamide

C6H7NO3S — CID 637557

IUPAC3-hydroxybenzenesulfonamide
SMILESNS(=O)(=O)c1cccc(O)c1
InChIInChI=1S/C6H7NO3S/c7-11(9,10)6-3-1-2-5(8)4-6/h1-4,8H,(H2,7,9,10)
InChIKeyOQPPWRYNXRWUAQ-UHFFFAOYSA-N
MW173.19 g/mol
LogP0.04
Rot. Bonds1

About 3-hydroxybenzenesulfonamide

3-hydroxybenzenesulfonamide (PubChem CID 637557) has the molecular formula C6H7NO3S and a molecular weight of 173.19 g/mol. Its IUPAC name is 3-hydroxybenzenesulfonamide.

Molecular Properties

Compound Name3-hydroxybenzenesulfonamide
PubChem CID637557
Molecular FormulaC6H7NO3S
Molecular Weight173.19 g/mol
Exact Mass173.01
IUPAC Name3-hydroxybenzenesulfonamide
SMILESNS(=O)(=O)c1cccc(O)c1
InChIInChI=1S/C6H7NO3S/c7-11(9,10)6-3-1-2-5(8)4-6/h1-4,8H,(H2,7,9,10)
InChIKeyOQPPWRYNXRWUAQ-UHFFFAOYSA-N
XLogP0.04
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.19
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxybenzenesulfonamide?
The IUPAC name of 3-hydroxybenzenesulfonamide (CID 637557) is 3-hydroxybenzenesulfonamide.
What is the SMILES notation for 3-hydroxybenzenesulfonamide?
The canonical SMILES for 3-hydroxybenzenesulfonamide is NS(=O)(=O)c1cccc(O)c1.
What is the InChIKey of 3-hydroxybenzenesulfonamide?
The InChIKey is OQPPWRYNXRWUAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO3S/c7-11(9,10)6-3-1-2-5(8)4-6/h1-4,8H,(H2,7,9,10).
What are the key properties of 3-hydroxybenzenesulfonamide?
3-hydroxybenzenesulfonamide has a molecular weight of 173.19 g/mol, XLogP of 0.04, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxybenzenesulfonamide is sourced from PubChem (CID 637557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).