4-hydroxy-N-propylbenzenesulfonamide

C9H13NO3S — CID 21127856

IUPAC4-hydroxy-N-propylbenzenesulfonamide
SMILESCCCNS(=O)(=O)c1ccc(O)cc1
InChIInChI=1S/C9H13NO3S/c1-2-7-10-14(12,13)9-5-3-8(11)4-6-9/h3-6,10-11H,2,7H2,1H3
InChIKeyWUUUOCMXAGTQFV-UHFFFAOYSA-N
MW215.27 g/mol
LogP1.08
Rot. Bonds4

About 4-hydroxy-N-propylbenzenesulfonamide

4-hydroxy-N-propylbenzenesulfonamide (PubChem CID 21127856) has the molecular formula C9H13NO3S and a molecular weight of 215.27 g/mol. Its IUPAC name is 4-hydroxy-N-propylbenzenesulfonamide.

Molecular Properties

Compound Name4-hydroxy-N-propylbenzenesulfonamide
PubChem CID21127856
Molecular FormulaC9H13NO3S
Molecular Weight215.27 g/mol
Exact Mass215.06
IUPAC Name4-hydroxy-N-propylbenzenesulfonamide
SMILESCCCNS(=O)(=O)c1ccc(O)cc1
InChIInChI=1S/C9H13NO3S/c1-2-7-10-14(12,13)9-5-3-8(11)4-6-9/h3-6,10-11H,2,7H2,1H3
InChIKeyWUUUOCMXAGTQFV-UHFFFAOYSA-N
XLogP1.08
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.27
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-hydroxy-N-propylbenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-propylbenzenesulfonamide?
The IUPAC name of 4-hydroxy-N-propylbenzenesulfonamide (CID 21127856) is 4-hydroxy-N-propylbenzenesulfonamide.
What is the SMILES notation for 4-hydroxy-N-propylbenzenesulfonamide?
The canonical SMILES for 4-hydroxy-N-propylbenzenesulfonamide is CCCNS(=O)(=O)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-propylbenzenesulfonamide?
The InChIKey is WUUUOCMXAGTQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO3S/c1-2-7-10-14(12,13)9-5-3-8(11)4-6-9/h3-6,10-11H,2,7H2,1H3.
What are the key properties of 4-hydroxy-N-propylbenzenesulfonamide?
4-hydroxy-N-propylbenzenesulfonamide has a molecular weight of 215.27 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-propylbenzenesulfonamide is sourced from PubChem (CID 21127856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).