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

C11H18ClN3O2S — CID 64607176

IUPAC5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide
SMILESCCC(C)(C)NS(=O)(=O)c1cnc(NC)c(Cl)c1
InChIInChI=1S/C11H18ClN3O2S/c1-5-11(2,3)15-18(16,17)8-6-9(12)10(13-4)14-7-8/h6-7,15H,5H2,1-4H3,(H,13,14)
InChIKeyUIMQXRHVGBULRP-UHFFFAOYSA-N
MW291.80 g/mol
LogP2.24
Rot. Bonds5

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

5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide (PubChem CID 64607176) has the molecular formula C11H18ClN3O2S and a molecular weight of 291.80 g/mol. Its IUPAC name is 5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide
PubChem CID64607176
Molecular FormulaC11H18ClN3O2S
Molecular Weight291.80 g/mol
Exact Mass291.08
IUPAC Name5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide
SMILESCCC(C)(C)NS(=O)(=O)c1cnc(NC)c(Cl)c1
InChIInChI=1S/C11H18ClN3O2S/c1-5-11(2,3)15-18(16,17)8-6-9(12)10(13-4)14-7-8/h6-7,15H,5H2,1-4H3,(H,13,14)
InChIKeyUIMQXRHVGBULRP-UHFFFAOYSA-N
XLogP2.24
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.80
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5,6-dichloro-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide
CID 64624600
5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide
CID 64607730
5-chloro-6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-sulfonamide
CID 64602290
5-chloro-N-hexyl-6-(methylamino)pyridine-3-sulfonamide
CID 64602106
3-chloro-4-(methylaminomethyl)-N-(2-methylbutan-2-yl)benzenesulfonamide
CID 106031458
5-chloro-6-(methylamino)-N-(2,2,3,3-tetrafluoropropyl)pyridine-3-sulfonamide
CID 106295502
5-chloro-N-(2-cyclopentylethyl)-6-(methylamino)pyridine-3-sulfonamide
CID 64600883
5-chloro-N,N-dimethyl-6-(methylamino)pyridine-3-sulfonamide
CID 64607736
2-[[5-chloro-6-(methylamino)-3-pyridinyl]sulfonylamino]-N-cyclopropylacetamide
CID 64601658
5-chloro-6-(methylamino)-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-3-sulfonamide
CID 80685568
5-chloro-N-(2,5-dichlorophenyl)-6-(methylamino)pyridine-3-sulfonamide
CID 64606214
5-chloro-N-(3-ethyl-1-methylpyrazol-4-yl)-6-(methylamino)pyridine-3-sulfonamide
CID 107464615

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide (CID 64607176) is 5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide is CCC(C)(C)NS(=O)(=O)c1cnc(NC)c(Cl)c1.
What is the InChIKey of 5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide?
The InChIKey is UIMQXRHVGBULRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClN3O2S/c1-5-11(2,3)15-18(16,17)8-6-9(12)10(13-4)14-7-8/h6-7,15H,5H2,1-4H3,(H,13,14).
What are the key properties of 5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide?
5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide has a molecular weight of 291.80 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 64607176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).