2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine

C34H24N2 — CID 140587116

IUPAC2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine
SMILESc1ccc(-c2cc(-c3cccc(-c4cccc(-c5ccccn5)c4)c3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C34H24N2/c1-3-11-25(12-4-1)33-23-31(24-34(36-33)26-13-5-2-6-14-26)29-17-9-15-27(21-29)28-16-10-18-30(22-28)32-19-7-8-20-35-32/h1-24H
InChIKeyWWSXTZQTZKUUQS-UHFFFAOYSA-N
MW460.58 g/mol
LogP8.81
Rot. Bonds5

About 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine

2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine (PubChem CID 140587116) has the molecular formula C34H24N2 and a molecular weight of 460.58 g/mol. Its IUPAC name is 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine.

Molecular Properties

Compound Name2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine
PubChem CID140587116
Molecular FormulaC34H24N2
Molecular Weight460.58 g/mol
Exact Mass460.19
IUPAC Name2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine
SMILESc1ccc(-c2cc(-c3cccc(-c4cccc(-c5ccccn5)c4)c3)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C34H24N2/c1-3-11-25(12-4-1)33-23-31(24-34(36-33)26-13-5-2-6-14-26)29-17-9-15-27(21-29)28-16-10-18-30(22-28)32-19-7-8-20-35-32/h1-24H
InChIKeyWWSXTZQTZKUUQS-UHFFFAOYSA-N
XLogP8.81
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms36
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500460.58
LogP ≤ 58.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine?
The IUPAC name of 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine (CID 140587116) is 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine.
What is the SMILES notation for 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine?
The canonical SMILES for 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine is c1ccc(-c2cc(-c3cccc(-c4cccc(-c5ccccn5)c4)c3)cc(-c3ccccc3)n2)cc1.
What is the InChIKey of 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine?
The InChIKey is WWSXTZQTZKUUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24N2/c1-3-11-25(12-4-1)33-23-31(24-34(36-33)26-13-5-2-6-14-26)29-17-9-15-27(21-29)28-16-10-18-30(22-28)32-19-7-8-20-35-32/h1-24H.
What are the key properties of 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine?
2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine has a molecular weight of 460.58 g/mol, XLogP of 8.81, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine is sourced from PubChem (CID 140587116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).