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 Name | 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine |
| PubChem CID | 142562263 |
| Molecular Formula | C23H18N2O |
| Molecular Weight | 338.41 g/mol |
| Exact Mass | 338.14 |
| IUPAC Name | 2-[3-(3-methyl-5-pyridin-2-ylphenoxy)phenyl]pyridine |
| SMILES | Cc1cc(Oc2cccc(-c3ccccn3)c2)cc(-c2ccccn2)c1 |
| InChI | 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 |
| InChIKey | HUMQVZOWCPDHEG-UHFFFAOYSA-N |
| XLogP | 5.91 |
| TPSA | 35.01 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 338.41 |
| LogP ≤ 5 | 5.91 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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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).