5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide

C13H20ClN3O2S — CID 64600545

IUPAC5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)NC2CCCC2C)cc1Cl
InChIInChI=1S/C13H20ClN3O2S/c1-3-15-13-11(14)7-10(8-16-13)20(18,19)17-12-6-4-5-9(12)2/h7-9,12,17H,3-6H2,1-2H3,(H,15,16)
InChIKeyDYDPSBIEZDMKCB-UHFFFAOYSA-N
MW317.84 g/mol
LogP2.63
Rot. Bonds5

About 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide

5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide (PubChem CID 64600545) has the molecular formula C13H20ClN3O2S and a molecular weight of 317.84 g/mol. Its IUPAC name is 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide
PubChem CID64600545
Molecular FormulaC13H20ClN3O2S
Molecular Weight317.84 g/mol
Exact Mass317.10
IUPAC Name5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)NC2CCCC2C)cc1Cl
InChIInChI=1S/C13H20ClN3O2S/c1-3-15-13-11(14)7-10(8-16-13)20(18,19)17-12-6-4-5-9(12)2/h7-9,12,17H,3-6H2,1-2H3,(H,15,16)
InChIKeyDYDPSBIEZDMKCB-UHFFFAOYSA-N
XLogP2.63
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.84
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide (CID 64600545) is 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide is CCNc1ncc(S(=O)(=O)NC2CCCC2C)cc1Cl.
What is the InChIKey of 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide?
The InChIKey is DYDPSBIEZDMKCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClN3O2S/c1-3-15-13-11(14)7-10(8-16-13)20(18,19)17-12-6-4-5-9(12)2/h7-9,12,17H,3-6H2,1-2H3,(H,15,16).
What are the key properties of 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide?
5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide has a molecular weight of 317.84 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide is sourced from PubChem (CID 64600545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).