5-methylsulfanyl-2-pyridin-3-ylpyridine

C11H10N2S — CID 123833114

IUPAC5-methylsulfanyl-2-pyridin-3-ylpyridine
SMILESCSc1ccc(-c2cccnc2)nc1
InChIInChI=1S/C11H10N2S/c1-14-10-4-5-11(13-8-10)9-3-2-6-12-7-9/h2-8H,1H3
InChIKeyLIPZXZISLXPFOI-UHFFFAOYSA-N
MW202.28 g/mol
LogP2.87
Rot. Bonds2

About 5-methylsulfanyl-2-pyridin-3-ylpyridine

5-methylsulfanyl-2-pyridin-3-ylpyridine (PubChem CID 123833114) has the molecular formula C11H10N2S and a molecular weight of 202.28 g/mol. Its IUPAC name is 5-methylsulfanyl-2-pyridin-3-ylpyridine.

Molecular Properties

Compound Name5-methylsulfanyl-2-pyridin-3-ylpyridine
PubChem CID123833114
Molecular FormulaC11H10N2S
Molecular Weight202.28 g/mol
Exact Mass202.06
IUPAC Name5-methylsulfanyl-2-pyridin-3-ylpyridine
SMILESCSc1ccc(-c2cccnc2)nc1
InChIInChI=1S/C11H10N2S/c1-14-10-4-5-11(13-8-10)9-3-2-6-12-7-9/h2-8H,1H3
InChIKeyLIPZXZISLXPFOI-UHFFFAOYSA-N
XLogP2.87
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyridin-3-yl-5-[5-[5-(5-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine
CID 101019648
N-(5-methylsulfanyl-2-pyridinyl)-3-pyridin-3-yl-1,2-oxazole-5-carboxamide
CID 167813221
2-pyridin-2-yl-5-(5-pyridin-3-yl-2-pyridinyl)pyridine
CID 100956208
5-(4-methoxyphenyl)-2-pyridin-3-ylpyridine
CID 59027680
2-(4-methylsulfanylphenyl)-5-pyridin-3-yl-1,3,4-oxadiazole
CID 25055628
2-pyridin-3-ylpyridine;dihydrochloride
CID 67024611
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
4-methylsulfanyl-6-pyridin-3-yl-1H-pyridin-2-one
CID 123419683
5-pyridin-3-yl-1,2,4-triazine
CID 141083595
N,N-diphenyl-6-pyridin-3-ylpyridin-3-amine
CID 15982920
5-isocyanato-2-pyridin-3-ylpyridine
CID 83915829
5-[6-(4-fluorophenyl)naphthalen-2-yl]-2-pyridin-3-ylpyridine
CID 169294016

Frequently Asked Questions

What is the IUPAC name of 5-methylsulfanyl-2-pyridin-3-ylpyridine?
The IUPAC name of 5-methylsulfanyl-2-pyridin-3-ylpyridine (CID 123833114) is 5-methylsulfanyl-2-pyridin-3-ylpyridine.
What is the SMILES notation for 5-methylsulfanyl-2-pyridin-3-ylpyridine?
The canonical SMILES for 5-methylsulfanyl-2-pyridin-3-ylpyridine is CSc1ccc(-c2cccnc2)nc1.
What is the InChIKey of 5-methylsulfanyl-2-pyridin-3-ylpyridine?
The InChIKey is LIPZXZISLXPFOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2S/c1-14-10-4-5-11(13-8-10)9-3-2-6-12-7-9/h2-8H,1H3.
What are the key properties of 5-methylsulfanyl-2-pyridin-3-ylpyridine?
5-methylsulfanyl-2-pyridin-3-ylpyridine has a molecular weight of 202.28 g/mol, XLogP of 2.87, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylsulfanyl-2-pyridin-3-ylpyridine is sourced from PubChem (CID 123833114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).