About 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine
3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine (PubChem CID 71141792) has the molecular formula C20H19NO
and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine.
Molecular Properties
| Compound Name | 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine |
| PubChem CID | 71141792 |
| Molecular Formula | C20H19NO |
| Molecular Weight | 289.38 g/mol |
| Exact Mass | 289.15 |
| IUPAC Name | 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine |
| SMILES | CCc1cccc(-c2cncc(-c3cccc(OC)c3)c2)c1 |
| InChI | InChI=1S/C20H19NO/c1-3-15-6-4-7-16(10-15)18-11-19(14-21-13-18)17-8-5-9-20(12-17)22-2/h4-14H,3H2,1-2H3 |
| InChIKey | FMEZQKPFZLVDLM-UHFFFAOYSA-N |
| XLogP | 4.99 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 289.38 |
| LogP ≤ 5 | 4.99 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine?
The IUPAC name of 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine (CID 71141792) is 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine.
What is the SMILES notation for 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine?
The canonical SMILES for 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine is CCc1cccc(-c2cncc(-c3cccc(OC)c3)c2)c1.
What is the InChIKey of 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine?
The InChIKey is FMEZQKPFZLVDLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO/c1-3-15-6-4-7-16(10-15)18-11-19(14-21-13-18)17-8-5-9-20(12-17)22-2/h4-14H,3H2,1-2H3.
What are the key properties of 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine?
3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine has a molecular weight of 289.38 g/mol, XLogP of 4.99, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylphenyl)-5-(3-methoxyphenyl)pyridine is sourced from PubChem (CID 71141792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).