2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine

C18H12N2S2 — CID 10734487

IUPAC2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine
SMILESc1ccc(-c2cc(-c3cccs3)cc(-c3cccs3)n2)nc1
InChIInChI=1S/C18H12N2S2/c1-2-8-19-14(5-1)15-11-13(17-6-3-9-21-17)12-16(20-15)18-7-4-10-22-18/h1-12H
InChIKeyCJXCYURLNIWMMC-UHFFFAOYSA-N
MW320.44 g/mol
LogP5.60
Rot. Bonds3

About 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine

2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine (PubChem CID 10734487) has the molecular formula C18H12N2S2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine.

Molecular Properties

Compound Name2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine
PubChem CID10734487
Molecular FormulaC18H12N2S2
Molecular Weight320.44 g/mol
Exact Mass320.04
IUPAC Name2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine
SMILESc1ccc(-c2cc(-c3cccs3)cc(-c3cccs3)n2)nc1
InChIInChI=1S/C18H12N2S2/c1-2-8-19-14(5-1)15-11-13(17-6-3-9-21-17)12-16(20-15)18-7-4-10-22-18/h1-12H
InChIKeyCJXCYURLNIWMMC-UHFFFAOYSA-N
XLogP5.60
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.44
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

platinum;bis(2-thiophen-2-ylpyridine)
CID 87764255
2-[3-[3-(3-phenyl-5-thiophen-2-ylphenyl)phenyl]phenyl]pyridine
CID 140587162
2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-[2-pyridin-2-yl-6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-4-pyridinyl]pyridine
CID 15448140
4-[6-[6-(2,6-dipyridin-2-yl-4-pyridinyl)-2-pyridinyl]-2-pyridinyl]-2,6-dipyridin-2-ylpyridine
CID 171935887
4-[3-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 102048585
4-phenyl-2-[6-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-6-pyridin-2-ylpyridine
CID 15788654
4-[4-[2-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122364716
4,6-diphenyl-2-[4-[3-[4-(4-phenyl-6-pyridin-2-ylpyrimidin-2-yl)phenyl]pentan-3-yl]phenyl]pyrimidine;4-phenyl-6-(3-phenylphenyl)-2-[4-[3-[4-[4-phenyl-6-(3-phenylphenyl)pyrimidin-2-yl]phenyl]pentan-3-yl]phenyl]pyrimidine;4-phenyl-6-(4-phenylphenyl)-2-[4-[3-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]pentan-3-yl]phenyl]pyrimidine;4-phenyl-2-[4-[3-[4-(4-phenyl-6-thiophen-2-ylpyrimidin-2-yl)phenyl]pentan-3-yl]phenyl]-6-thiophen-2-ylpyrimidine
CID 158746588
CID 78319328
CID 78319328
4-[5-[5-(2,6-dipyridin-2-yl-4-pyridinyl)-4-methylthiophen-2-yl]-3-methylthiophen-2-yl]-2,6-dipyridin-2-ylpyridine
CID 102264040
3-(4-chlorophenyl)-6-pyridin-2-yl-2-thiophen-2-ylpyridine
CID 86226405
4-(5-nitrothiophen-2-yl)-2,6-dipyridin-2-ylpyridine
CID 11417084

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine?
The IUPAC name of 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine (CID 10734487) is 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine.
What is the SMILES notation for 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine?
The canonical SMILES for 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine is c1ccc(-c2cc(-c3cccs3)cc(-c3cccs3)n2)nc1.
What is the InChIKey of 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine?
The InChIKey is CJXCYURLNIWMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12N2S2/c1-2-8-19-14(5-1)15-11-13(17-6-3-9-21-17)12-16(20-15)18-7-4-10-22-18/h1-12H.
What are the key properties of 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine?
2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine has a molecular weight of 320.44 g/mol, XLogP of 5.60, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-4,6-dithiophen-2-ylpyridine is sourced from PubChem (CID 10734487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).