6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide

C13H19ClN2O3S — CID 61046307

IUPAC6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(c1ccc(Cl)nc1)N(CCO)C1CCCCC1
InChIInChI=1S/C13H19ClN2O3S/c14-13-7-6-12(10-15-13)20(18,19)16(8-9-17)11-4-2-1-3-5-11/h6-7,10-11,17H,1-5,8-9H2
InChIKeyLMXITPDMGJGKSB-UHFFFAOYSA-N
MW318.83 g/mol
LogP2.05
Rot. Bonds5

About 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide

6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide (PubChem CID 61046307) has the molecular formula C13H19ClN2O3S and a molecular weight of 318.83 g/mol. Its IUPAC name is 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide
PubChem CID61046307
Molecular FormulaC13H19ClN2O3S
Molecular Weight318.83 g/mol
Exact Mass318.08
IUPAC Name6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(c1ccc(Cl)nc1)N(CCO)C1CCCCC1
InChIInChI=1S/C13H19ClN2O3S/c14-13-7-6-12(10-15-13)20(18,19)16(8-9-17)11-4-2-1-3-5-11/h6-7,10-11,17H,1-5,8-9H2
InChIKeyLMXITPDMGJGKSB-UHFFFAOYSA-N
XLogP2.05
TPSA70.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.83
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

5,6-dichloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide
CID 64607444
6-chloro-N-cyclopropyl-N-ethylpyridine-3-sulfonamide
CID 43243310
6-chloro-N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
CID 54983763
5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)-6-(methylamino)pyridine-3-sulfonamide
CID 102870293
5-chloro-N-cyclohexyl-N-(2-hydroxyethyl)thiophene-2-sulfonamide
CID 54998995
2-chloro-4-[cyclobutyl(2-hydroxyethyl)sulfamoyl]benzenecarbothioamide
CID 102862562
6-chloro-N-(2-hydroxycyclohexyl)-N-methylpyridine-3-sulfonamide
CID 102631872
3-amino-N-cyclopentyl-4-ethyl-N-(2-hydroxyethyl)benzenesulfonamide
CID 61140381
6-chloro-N-[2-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
CID 103836075
3-amino-N-cyclopentyl-4-fluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 61140188
N-cyclohexyl-N-(2-hydroxyethyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103414836
6-chloro-N-cyclooctylpyridine-3-sulfonamide
CID 7938157

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide?
The IUPAC name of 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide (CID 61046307) is 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide is O=S(=O)(c1ccc(Cl)nc1)N(CCO)C1CCCCC1.
What is the InChIKey of 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide?
The InChIKey is LMXITPDMGJGKSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O3S/c14-13-7-6-12(10-15-13)20(18,19)16(8-9-17)11-4-2-1-3-5-11/h6-7,10-11,17H,1-5,8-9H2.
What are the key properties of 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide?
6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide has a molecular weight of 318.83 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 61046307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).