3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine

C24H20N2 — CID 67264691

IUPAC3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine
SMILESc1ccc(-c2ccccc2CC(c2cccnc2)c2cccnc2)cc1
InChIInChI=1S/C24H20N2/c1-2-8-19(9-3-1)23-13-5-4-10-20(23)16-24(21-11-6-14-25-17-21)22-12-7-15-26-18-22/h1-15,17-18,24H,16H2
InChIKeyTYYSIBSRZTXCNR-UHFFFAOYSA-N
MW336.44 g/mol
LogP5.52
Rot. Bonds5

About 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine

3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine (PubChem CID 67264691) has the molecular formula C24H20N2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine.

Molecular Properties

Compound Name3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine
PubChem CID67264691
Molecular FormulaC24H20N2
Molecular Weight336.44 g/mol
Exact Mass336.16
IUPAC Name3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine
SMILESc1ccc(-c2ccccc2CC(c2cccnc2)c2cccnc2)cc1
InChIInChI=1S/C24H20N2/c1-2-8-19(9-3-1)23-13-5-4-10-20(23)16-24(21-11-6-14-25-17-21)22-12-7-15-26-18-22/h1-15,17-18,24H,16H2
InChIKeyTYYSIBSRZTXCNR-UHFFFAOYSA-N
XLogP5.52
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.44
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine?
The IUPAC name of 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine (CID 67264691) is 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine.
What is the SMILES notation for 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine?
The canonical SMILES for 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine is c1ccc(-c2ccccc2CC(c2cccnc2)c2cccnc2)cc1.
What is the InChIKey of 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine?
The InChIKey is TYYSIBSRZTXCNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2/c1-2-8-19(9-3-1)23-13-5-4-10-20(23)16-24(21-11-6-14-25-17-21)22-12-7-15-26-18-22/h1-15,17-18,24H,16H2.
What are the key properties of 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine?
3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine has a molecular weight of 336.44 g/mol, XLogP of 5.52, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-phenylphenyl)-1-pyridin-3-ylethyl]pyridine is sourced from PubChem (CID 67264691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).