2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide

C12H17NO3S — CID 81245733

IUPAC2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide
SMILESCC1(NS(=O)(=O)c2ccccc2O)CCCC1
InChIInChI=1S/C12H17NO3S/c1-12(8-4-5-9-12)13-17(15,16)11-7-3-2-6-10(11)14/h2-3,6-7,13-14H,4-5,8-9H2,1H3
InChIKeyCYSNWLMIWGDJKA-UHFFFAOYSA-N
MW255.34 g/mol
LogP2.00
Rot. Bonds3

About 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide

2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide (PubChem CID 81245733) has the molecular formula C12H17NO3S and a molecular weight of 255.34 g/mol. Its IUPAC name is 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide.

Molecular Properties

Compound Name2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide
PubChem CID81245733
Molecular FormulaC12H17NO3S
Molecular Weight255.34 g/mol
Exact Mass255.09
IUPAC Name2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide
SMILESCC1(NS(=O)(=O)c2ccccc2O)CCCC1
InChIInChI=1S/C12H17NO3S/c1-12(8-4-5-9-12)13-17(15,16)11-7-3-2-6-10(11)14/h2-3,6-7,13-14H,4-5,8-9H2,1H3
InChIKeyCYSNWLMIWGDJKA-UHFFFAOYSA-N
XLogP2.00
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide 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 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide?
The IUPAC name of 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide (CID 81245733) is 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide.
What is the SMILES notation for 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide?
The canonical SMILES for 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide is CC1(NS(=O)(=O)c2ccccc2O)CCCC1.
What is the InChIKey of 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide?
The InChIKey is CYSNWLMIWGDJKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3S/c1-12(8-4-5-9-12)13-17(15,16)11-7-3-2-6-10(11)14/h2-3,6-7,13-14H,4-5,8-9H2,1H3.
What are the key properties of 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide?
2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide has a molecular weight of 255.34 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(1-methylcyclopentyl)benzenesulfonamide is sourced from PubChem (CID 81245733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).