5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide

C13H20ClN3O2S — CID 64600883

IUPAC5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide
SMILESCNc1ncc(S(=O)(=O)NCCC2CCCC2)cc1Cl
InChIInChI=1S/C13H20ClN3O2S/c1-15-13-12(14)8-11(9-16-13)20(18,19)17-7-6-10-4-2-3-5-10/h8-10,17H,2-7H2,1H3,(H,15,16)
InChIKeyHWVMABOKEONSBB-UHFFFAOYSA-N
MW317.84 g/mol
LogP2.64
Rot. Bonds6

About 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide

5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide (PubChem CID 64600883) has the molecular formula C13H20ClN3O2S and a molecular weight of 317.84 g/mol. Its IUPAC name is 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide
PubChem CID64600883
Molecular FormulaC13H20ClN3O2S
Molecular Weight317.84 g/mol
Exact Mass317.10
IUPAC Name5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide
SMILESCNc1ncc(S(=O)(=O)NCCC2CCCC2)cc1Cl
InChIInChI=1S/C13H20ClN3O2S/c1-15-13-12(14)8-11(9-16-13)20(18,19)17-7-6-10-4-2-3-5-10/h8-10,17H,2-7H2,1H3,(H,15,16)
InChIKeyHWVMABOKEONSBB-UHFFFAOYSA-N
XLogP2.64
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.84
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(2-cyclobutylethyl)-6-hydrazinylpyridine-3-sulfonamide
CID 113479037
5-chloro-6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-sulfonamide
CID 64602290
5-chloro-N-(cyclopentylmethyl)-6-(propylamino)pyridine-3-sulfonamide
CID 64606620
5-chloro-N-hexyl-6-(methylamino)pyridine-3-sulfonamide
CID 64602106
6-amino-5-chloro-N-(3-cyclopentylpropyl)pyridine-3-sulfonamide
CID 106014920
5-bromo-N-(2-cyclohexylethyl)-2-(methylamino)pyridine-3-sulfonamide
CID 63473639
2-[[5-chloro-6-(methylamino)-3-pyridinyl]sulfonylamino]-N-cyclopropylacetamide
CID 64601658
3-chloro-N-methyl-5-(4-propylpiperidin-1-yl)sulfonylpyridin-2-amine
CID 64601309
5-chloro-6-(methylamino)-N-(2-morpholin-4-ylethyl)pyridine-3-sulfonamide
CID 64608502
5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide
CID 64607730
5-chloro-6-(methylamino)-N-(2,2,3,3-tetrafluoropropyl)pyridine-3-sulfonamide
CID 106295502
5-chloro-6-(methylamino)-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-3-sulfonamide
CID 80685568

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide (CID 64600883) is 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide is CNc1ncc(S(=O)(=O)NCCC2CCCC2)cc1Cl.
What is the InChIKey of 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide?
The InChIKey is HWVMABOKEONSBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClN3O2S/c1-15-13-12(14)8-11(9-16-13)20(18,19)17-7-6-10-4-2-3-5-10/h8-10,17H,2-7H2,1H3,(H,15,16).
What are the key properties of 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide?
5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide has a molecular weight of 317.84 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 64600883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).