2-(2-methylbutan-2-yldisulfanyl)pyridine

C10H15NS2 — CID 88916521

IUPAC2-(2-methylbutan-2-yldisulfanyl)pyridine
SMILESCCC(C)(C)SSc1ccccn1
InChIInChI=1S/C10H15NS2/c1-4-10(2,3)13-12-9-7-5-6-8-11-9/h5-8H,4H2,1-3H3
InChIKeyCLZCJWWAYCTULZ-UHFFFAOYSA-N
MW213.37 g/mol
LogP4.01
Rot. Bonds4

About 2-(2-methylbutan-2-yldisulfanyl)pyridine

2-(2-methylbutan-2-yldisulfanyl)pyridine (PubChem CID 88916521) has the molecular formula C10H15NS2 and a molecular weight of 213.37 g/mol. Its IUPAC name is 2-(2-methylbutan-2-yldisulfanyl)pyridine.

Molecular Properties

Compound Name2-(2-methylbutan-2-yldisulfanyl)pyridine
PubChem CID88916521
Molecular FormulaC10H15NS2
Molecular Weight213.37 g/mol
Exact Mass213.06
IUPAC Name2-(2-methylbutan-2-yldisulfanyl)pyridine
SMILESCCC(C)(C)SSc1ccccn1
InChIInChI=1S/C10H15NS2/c1-4-10(2,3)13-12-9-7-5-6-8-11-9/h5-8H,4H2,1-3H3
InChIKeyCLZCJWWAYCTULZ-UHFFFAOYSA-N
XLogP4.01
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.37
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}

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Related Compounds

ethane;2-(3,5,5-trimethylheptan-3-yldisulfanyl)pyridine
CID 170620086
2-(tert-butyldisulfanyl)pyridine;S-tert-butyl ethanethioate
CID 157392300
2-[(2,4,4-trimethyl-5-propoxyhexan-2-yl)disulfanyl]pyridine
CID 156707093
2-(pyridin-2-yldisulfanyl)pyridine;tin(4+);tetrachloride
CID 21452483
2-methyl-N-pyridin-2-ylsulfanylbutan-2-amine
CID 21196944
ethene;2-(pyridin-2-yldisulfanyl)pyridine
CID 130237828
3-[hydroxy-[3-methyl-3-(pyridin-2-yldisulfanyl)butyl]phosphoryl]propanoic acid
CID 118341991
2-(2,2-dimethylpropylsulfanyl)pyridine
CID 20674343
(2R)-2-methyl-2-pyridin-2-ylsulfanylbutanenitrile
CID 125486794
2-(pyridin-2-ylhexasulfanyl)pyridine
CID 87930543
2,6-dimethyl-2-[2-methyl-2-(pyridin-2-yldisulfanyl)propoxy]nonan-5-one
CID 146565828
2-(methyltrisulfanyl)pyridine
CID 123388448

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylbutan-2-yldisulfanyl)pyridine?
The IUPAC name of 2-(2-methylbutan-2-yldisulfanyl)pyridine (CID 88916521) is 2-(2-methylbutan-2-yldisulfanyl)pyridine.
What is the SMILES notation for 2-(2-methylbutan-2-yldisulfanyl)pyridine?
The canonical SMILES for 2-(2-methylbutan-2-yldisulfanyl)pyridine is CCC(C)(C)SSc1ccccn1.
What is the InChIKey of 2-(2-methylbutan-2-yldisulfanyl)pyridine?
The InChIKey is CLZCJWWAYCTULZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NS2/c1-4-10(2,3)13-12-9-7-5-6-8-11-9/h5-8H,4H2,1-3H3.
What are the key properties of 2-(2-methylbutan-2-yldisulfanyl)pyridine?
2-(2-methylbutan-2-yldisulfanyl)pyridine has a molecular weight of 213.37 g/mol, XLogP of 4.01, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylbutan-2-yldisulfanyl)pyridine is sourced from PubChem (CID 88916521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).