2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide

C11H15ClN2O3S — CID 62520137

IUPAC2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
SMILESO=S(=O)(NC1(CO)CCCC1)c1cccnc1Cl
InChIInChI=1S/C11H15ClN2O3S/c12-10-9(4-3-7-13-10)18(16,17)14-11(8-15)5-1-2-6-11/h3-4,7,14-15H,1-2,5-6,8H2
InChIKeyOIJRNMGOXUZTGE-UHFFFAOYSA-N
MW290.77 g/mol
LogP1.32
Rot. Bonds4

About 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide

2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide (PubChem CID 62520137) has the molecular formula C11H15ClN2O3S and a molecular weight of 290.77 g/mol. Its IUPAC name is 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
PubChem CID62520137
Molecular FormulaC11H15ClN2O3S
Molecular Weight290.77 g/mol
Exact Mass290.05
IUPAC Name2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
SMILESO=S(=O)(NC1(CO)CCCC1)c1cccnc1Cl
InChIInChI=1S/C11H15ClN2O3S/c12-10-9(4-3-7-13-10)18(16,17)14-11(8-15)5-1-2-6-11/h3-4,7,14-15H,1-2,5-6,8H2
InChIKeyOIJRNMGOXUZTGE-UHFFFAOYSA-N
XLogP1.32
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.77
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-Chloro-N-[5-(3-hydroxy-propyl)-8-pyridin-3-yl-octyl]-benzenesulfonamide
CID 10478324
6-chloro-N-(tetrahydro-2-furanylmethyl)-3-pyridinesulfonamide
CID 5151378
N-tert-butyl-6-chloropyridine-3-sulfonamide
CID 4729821
6-chloro-N-cyclopentylpyridine-3-sulfonamide
CID 16227304
2-chloro-N-[(2R)-2-hydroxybutyl]-5-(trifluoromethyl)pyridine-3-sulfonamide
CID 169261701
2-chloro-N-(2-hydroxybutyl)-5-(trifluoromethyl)pyridine-3-sulfonamide
CID 170315903
5-fluoro-N-[1-(hydroxymethyl)cyclohexyl]pyridine-3-sulfonamide
CID 55081981
6-chloro-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
CID 61046295
2-chloro-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
CID 61046669
5-fluoro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide
CID 62521593
5-chloro-N-[1-(2-fluorophenyl)-2-hydroxyethyl]pyridine-3-sulfonamide
CID 75388875
N-(2-cyclopentyl-2-hydroxyethyl)-6-(trifluoromethyl)pyridine-3-sulfonamide
CID 75453653

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide (CID 62520137) is 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide is O=S(=O)(NC1(CO)CCCC1)c1cccnc1Cl.
What is the InChIKey of 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide?
The InChIKey is OIJRNMGOXUZTGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O3S/c12-10-9(4-3-7-13-10)18(16,17)14-11(8-15)5-1-2-6-11/h3-4,7,14-15H,1-2,5-6,8H2.
What are the key properties of 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide?
2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide has a molecular weight of 290.77 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[1-(hydroxymethyl)cyclopentyl]pyridine-3-sulfonamide is sourced from PubChem (CID 62520137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).