2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine

C16H13NS2 — CID 139905761

IUPAC2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine
SMILESCSc1sccc1-c1cccc(-c2ccccc2)n1
InChIInChI=1S/C16H13NS2/c1-18-16-13(10-11-19-16)15-9-5-8-14(17-15)12-6-3-2-4-7-12/h2-11H,1H3
InChIKeyKRCSMYSQJBLSMR-UHFFFAOYSA-N
MW283.42 g/mol
LogP5.20
Rot. Bonds3

About 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine

2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine (PubChem CID 139905761) has the molecular formula C16H13NS2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine.

Molecular Properties

Compound Name2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine
PubChem CID139905761
Molecular FormulaC16H13NS2
Molecular Weight283.42 g/mol
Exact Mass283.05
IUPAC Name2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine
SMILESCSc1sccc1-c1cccc(-c2ccccc2)n1
InChIInChI=1S/C16H13NS2/c1-18-16-13(10-11-19-16)15-9-5-8-14(17-15)12-6-3-2-4-7-12/h2-11H,1H3
InChIKeyKRCSMYSQJBLSMR-UHFFFAOYSA-N
XLogP5.20
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.42
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 5-methylsulfanyl-4-(6-phenyl-2-pyridinyl)thiophene-2-carboxylate
CID 18536958
2-methyl-6-(6-phenyl-2-pyridinyl)pyridine
CID 14698682
2-(2-methoxyphenyl)-6-(6-phenyl-2-pyridinyl)pyridine
CID 23135803
4-(2-methylsulfanylthiophen-3-yl)-N-(4-phenyldiazenylphenyl)-1,3-thiazol-2-amine
CID 139905758
2-(5-methylbenzo[b]phosphindol-4-yl)-6-phenylpyridine
CID 140916705
4,7-bis(6-phenyl-2-pyridinyl)-1,10-phenanthroline
CID 121420323
6-phenyl-N-[6-(2-thiophen-2-ylphenyl)-2-pyridinyl]pyridin-2-amine
CID 90070807
3-(6-phenyl-2-pyridinyl)-6-[6-(6-phenyl-2-pyridinyl)pyridazin-3-yl]pyridazine
CID 67041293
2-phenyl-6-pyridin-2-ylpyridine;platinum(2+)
CID 161405876
iridium(3+);2-phenyl-6-pyridin-2-ylpyridine
CID 159332179
1-(6-phenyl-2-pyridinyl)-9H-carbazole
CID 171438775
2-(1H-imidazol-2-yl)-6-phenylpyridine
CID 76900195

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine?
The IUPAC name of 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine (CID 139905761) is 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine.
What is the SMILES notation for 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine?
The canonical SMILES for 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine is CSc1sccc1-c1cccc(-c2ccccc2)n1.
What is the InChIKey of 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine?
The InChIKey is KRCSMYSQJBLSMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NS2/c1-18-16-13(10-11-19-16)15-9-5-8-14(17-15)12-6-3-2-4-7-12/h2-11H,1H3.
What are the key properties of 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine?
2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine has a molecular weight of 283.42 g/mol, XLogP of 5.20, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylsulfanylthiophen-3-yl)-6-phenylpyridine is sourced from PubChem (CID 139905761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).