About 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine
2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine (PubChem CID 135025720) has the molecular formula C20H17NO
and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine.
Molecular Properties
| Compound Name | 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine |
| PubChem CID | 135025720 |
| Molecular Formula | C20H17NO |
| Molecular Weight | 287.36 g/mol |
| Exact Mass | 287.13 |
| IUPAC Name | 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine |
| SMILES | COc1ccc(-c2cccc(/C=C/c3ccccc3)n2)cc1 |
| InChI | InChI=1S/C20H17NO/c1-22-19-14-11-17(12-15-19)20-9-5-8-18(21-20)13-10-16-6-3-2-4-7-16/h2-15H,1H3/b13-10+ |
| InChIKey | GIGGIZROPPVIGC-JLHYYAGUSA-N |
| XLogP | 4.93 |
| 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 | 287.36 |
| LogP ≤ 5 | 4.93 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine?
The IUPAC name of 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine (CID 135025720) is 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine.
What is the SMILES notation for 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine?
The canonical SMILES for 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine is COc1ccc(-c2cccc(/C=C/c3ccccc3)n2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine?
The InChIKey is GIGGIZROPPVIGC-JLHYYAGUSA-N. The full InChI is InChI=1S/C20H17NO/c1-22-19-14-11-17(12-15-19)20-9-5-8-18(21-20)13-10-16-6-3-2-4-7-16/h2-15H,1H3/b13-10+.
What are the key properties of 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine?
2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine has a molecular weight of 287.36 g/mol, XLogP of 4.93, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-6-[(E)-2-phenylethenyl]pyridine is sourced from PubChem (CID 135025720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).