2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine

C23H18N2O — CID 142562263

IUPAC2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine
SMILESCc1cc(Oc2cccc(-c3ccccn3)c2)cc(-c2ccccn2)c1
InChIInChI=1S/C23H18N2O/c1-17-13-19(23-10-3-5-12-25-23)16-21(14-17)26-20-8-6-7-18(15-20)22-9-2-4-11-24-22/h2-16H,1H3
InChIKeyHUMQVZOWCPDHEG-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.91
Rot. Bonds4

About 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine

2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine (PubChem CID 142562263) has the molecular formula C23H18N2O and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine.

Molecular Properties

Compound Name2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine
PubChem CID142562263
Molecular FormulaC23H18N2O
Molecular Weight338.41 g/mol
Exact Mass338.14
IUPAC Name2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine
SMILESCc1cc(Oc2cccc(-c3ccccn3)c2)cc(-c2ccccn2)c1
InChIInChI=1S/C23H18N2O/c1-17-13-19(23-10-3-5-12-25-23)16-21(14-17)26-20-8-6-7-18(15-20)22-9-2-4-11-24-22/h2-16H,1H3
InChIKeyHUMQVZOWCPDHEG-UHFFFAOYSA-N
XLogP5.91
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 55.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine?
The IUPAC name of 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine (CID 142562263) is 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine.
What is the SMILES notation for 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine?
The canonical SMILES for 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine is Cc1cc(Oc2cccc(-c3ccccn3)c2)cc(-c2ccccn2)c1.
What is the InChIKey of 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine?
The InChIKey is HUMQVZOWCPDHEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c1-17-13-19(23-10-3-5-12-25-23)16-21(14-17)26-20-8-6-7-18(15-20)22-9-2-4-11-24-22/h2-16H,1H3.
What are the key properties of 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine?
2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine has a molecular weight of 338.41 g/mol, XLogP of 5.91, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine is sourced from PubChem (CID 142562263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).