2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine

C25H19N — CID 164669085

IUPAC2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine
SMILESC(=C/c1cc(-c2ccccc2)nc(-c2ccccc2)c1)\c1ccccc1
InChIInChI=1S/C25H19N/c1-4-10-20(11-5-1)16-17-21-18-24(22-12-6-2-7-13-22)26-25(19-21)23-14-8-3-9-15-23/h1-19H/b17-16+
InChIKeyPDFOBGLRJFFONM-WUKNDPDISA-N
MW333.43 g/mol
LogP6.59
Rot. Bonds4

About 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine

2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine (PubChem CID 164669085) has the molecular formula C25H19N and a molecular weight of 333.43 g/mol. Its IUPAC name is 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine.

Molecular Properties

Compound Name2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine
PubChem CID164669085
Molecular FormulaC25H19N
Molecular Weight333.43 g/mol
Exact Mass333.15
IUPAC Name2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine
SMILESC(=C/c1cc(-c2ccccc2)nc(-c2ccccc2)c1)\c1ccccc1
InChIInChI=1S/C25H19N/c1-4-10-20(11-5-1)16-17-21-18-24(22-12-6-2-7-13-22)26-25(19-21)23-14-8-3-9-15-23/h1-19H/b17-16+
InChIKeyPDFOBGLRJFFONM-WUKNDPDISA-N
XLogP6.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.43
LogP ≤ 56.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine?
The IUPAC name of 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine (CID 164669085) is 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine.
What is the SMILES notation for 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine?
The canonical SMILES for 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine is C(=C/c1cc(-c2ccccc2)nc(-c2ccccc2)c1)\c1ccccc1.
What is the InChIKey of 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine?
The InChIKey is PDFOBGLRJFFONM-WUKNDPDISA-N. The full InChI is InChI=1S/C25H19N/c1-4-10-20(11-5-1)16-17-21-18-24(22-12-6-2-7-13-22)26-25(19-21)23-14-8-3-9-15-23/h1-19H/b17-16+.
What are the key properties of 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine?
2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine has a molecular weight of 333.43 g/mol, XLogP of 6.59, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine is sourced from PubChem (CID 164669085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).