About 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine
2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine (PubChem CID 138757019) has the molecular formula C17H15NO2S
and a molecular weight of 297.38 g/mol. Its IUPAC name is 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine.
Molecular Properties
| Compound Name | 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine |
| PubChem CID | 138757019 |
| Molecular Formula | C17H15NO2S |
| Molecular Weight | 297.38 g/mol |
| Exact Mass | 297.08 |
| IUPAC Name | 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine |
| SMILES | COc1ccc(-c2ccc(-c3cccs3)nc2OC)cc1 |
| InChI | InChI=1S/C17H15NO2S/c1-19-13-7-5-12(6-8-13)14-9-10-15(18-17(14)20-2)16-4-3-11-21-16/h3-11H,1-2H3 |
| InChIKey | SJXNPFJYSHBRFK-UHFFFAOYSA-N |
| XLogP | 4.49 |
| TPSA | 31.35 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 297.38 |
| LogP ≤ 5 | 4.49 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine?
The IUPAC name of 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine (CID 138757019) is 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine.
What is the SMILES notation for 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine?
The canonical SMILES for 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine is COc1ccc(-c2ccc(-c3cccs3)nc2OC)cc1.
What is the InChIKey of 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine?
The InChIKey is SJXNPFJYSHBRFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2S/c1-19-13-7-5-12(6-8-13)14-9-10-15(18-17(14)20-2)16-4-3-11-21-16/h3-11H,1-2H3.
What are the key properties of 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine?
2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine has a molecular weight of 297.38 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-(4-methoxyphenyl)-6-thiophen-2-ylpyridine is sourced from PubChem (CID 138757019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).