3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine

C23H19N3 — CID 67264950

IUPAC3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine
SMILESc1cncc(C(Cc2ccccc2-c2ccncc2)c2cccnc2)c1
InChIInChI=1S/C23H19N3/c1-2-8-22(18-9-13-24-14-10-18)19(5-1)15-23(20-6-3-11-25-16-20)21-7-4-12-26-17-21/h1-14,16-17,23H,15H2
InChIKeyCITXEDFEYAKZMY-UHFFFAOYSA-N
MW337.43 g/mol
LogP4.91
Rot. Bonds5

About 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine

3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine (PubChem CID 67264950) has the molecular formula C23H19N3 and a molecular weight of 337.43 g/mol. Its IUPAC name is 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine.

Molecular Properties

Compound Name3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine
PubChem CID67264950
Molecular FormulaC23H19N3
Molecular Weight337.43 g/mol
Exact Mass337.16
IUPAC Name3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine
SMILESc1cncc(C(Cc2ccccc2-c2ccncc2)c2cccnc2)c1
InChIInChI=1S/C23H19N3/c1-2-8-22(18-9-13-24-14-10-18)19(5-1)15-23(20-6-3-11-25-16-20)21-7-4-12-26-17-21/h1-14,16-17,23H,15H2
InChIKeyCITXEDFEYAKZMY-UHFFFAOYSA-N
XLogP4.91
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 21855
CID 21855
CID 4761
CID 4761
CID 19861
CID 19861
CID 8405
CID 8405
CID 13651
CID 13651
CID 7132
CID 7132
CID 11107
CID 11107
CID 13886
CID 13886
CID 74937
CID 74937
CID 11389
CID 11389
CID 16458
CID 16458
CID 87019
CID 87019

Frequently Asked Questions

What is the IUPAC name of 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine?
The IUPAC name of 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine (CID 67264950) is 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine.
What is the SMILES notation for 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine?
The canonical SMILES for 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine is c1cncc(C(Cc2ccccc2-c2ccncc2)c2cccnc2)c1.
What is the InChIKey of 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine?
The InChIKey is CITXEDFEYAKZMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3/c1-2-8-22(18-9-13-24-14-10-18)19(5-1)15-23(20-6-3-11-25-16-20)21-7-4-12-26-17-21/h1-14,16-17,23H,15H2.
What are the key properties of 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine?
3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine has a molecular weight of 337.43 g/mol, XLogP of 4.91, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-pyridin-3-yl-2-(2-pyridin-4-ylphenyl)ethyl]pyridine is sourced from PubChem (CID 67264950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).