ethene;2-(pyridin-2-yldisulfanyl)pyridine

C12H12N2S2 — CID 130237828

IUPACethene;2-(pyridin-2-yldisulfanyl)pyridine
SMILESC=C.c1ccc(SSc2ccccn2)nc1
InChIInChI=1S/C10H8N2S2.C2H4/c1-3-7-11-9(5-1)13-14-10-6-2-4-8-12-10;1-2/h1-8H;1-2H2
InChIKeyGWGUNUVIEYVWTK-UHFFFAOYSA-N
MW248.38 g/mol
LogP4.08
Rot. Bonds3

About ethene;2-(pyridin-2-yldisulfanyl)pyridine

ethene;2-(pyridin-2-yldisulfanyl)pyridine (PubChem CID 130237828) has the molecular formula C12H12N2S2 and a molecular weight of 248.38 g/mol. Its IUPAC name is ethene;2-(pyridin-2-yldisulfanyl)pyridine.

Molecular Properties

Compound Nameethene;2-(pyridin-2-yldisulfanyl)pyridine
PubChem CID130237828
Molecular FormulaC12H12N2S2
Molecular Weight248.38 g/mol
Exact Mass248.04
IUPAC Nameethene;2-(pyridin-2-yldisulfanyl)pyridine
SMILESC=C.c1ccc(SSc2ccccn2)nc1
InChIInChI=1S/C10H8N2S2.C2H4/c1-3-7-11-9(5-1)13-14-10-6-2-4-8-12-10;1-2/h1-8H;1-2H2
InChIKeyGWGUNUVIEYVWTK-UHFFFAOYSA-N
XLogP4.08
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.38
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(pyridin-2-yldisulfanyl)pyridine;tin(4+);tetrachloride
CID 21452483
2-(pyridin-2-ylhexasulfanyl)pyridine
CID 87930543
2-(methyltrisulfanyl)pyridine
CID 123388448
2-chloro-6-(pyridin-2-yldisulfanyl)pyridine
CID 91874893
2-hydroxysulfanylpyridine
CID 12046445
2-sulfidosulfanylpyridine
CID 102510943
2-(but-3-enyldisulfanyl)pyridine
CID 89193061
2,4-dimethyl-6-(pyridin-2-yldisulfanyl)pyridine
CID 57270391
methyl-(pyridin-2-yldisulfanyl)-sulfanylidene-λ4-sulfane
CID 167277036
2-(disulfanyl)pyridine;mercury
CID 174835661
2-(pyridin-2-yldisulfanyl)pyridine-3-carbonitrile
CID 91874908
isocyanatoethane;2-(pyridin-2-yldisulfanyl)pyridine
CID 122690557

Frequently Asked Questions

What is the IUPAC name of ethene;2-(pyridin-2-yldisulfanyl)pyridine?
The IUPAC name of ethene;2-(pyridin-2-yldisulfanyl)pyridine (CID 130237828) is ethene;2-(pyridin-2-yldisulfanyl)pyridine.
What is the SMILES notation for ethene;2-(pyridin-2-yldisulfanyl)pyridine?
The canonical SMILES for ethene;2-(pyridin-2-yldisulfanyl)pyridine is C=C.c1ccc(SSc2ccccn2)nc1.
What is the InChIKey of ethene;2-(pyridin-2-yldisulfanyl)pyridine?
The InChIKey is GWGUNUVIEYVWTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2S2.C2H4/c1-3-7-11-9(5-1)13-14-10-6-2-4-8-12-10;1-2/h1-8H;1-2H2.
What are the key properties of ethene;2-(pyridin-2-yldisulfanyl)pyridine?
ethene;2-(pyridin-2-yldisulfanyl)pyridine has a molecular weight of 248.38 g/mol, XLogP of 4.08, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;2-(pyridin-2-yldisulfanyl)pyridine is sourced from PubChem (CID 130237828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).