About 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine
2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine (PubChem CID 175907027) has the molecular formula C16H19NO2
and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine.
Molecular Properties
| Compound Name | 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine |
| PubChem CID | 175907027 |
| Molecular Formula | C16H19NO2 |
| Molecular Weight | 257.33 g/mol |
| Exact Mass | 257.14 |
| IUPAC Name | 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine |
| SMILES | CCOc1cc(-c2ccccn2)c(OC)cc1CC |
| InChI | InChI=1S/C16H19NO2/c1-4-12-10-16(18-3)13(11-15(12)19-5-2)14-8-6-7-9-17-14/h6-11H,4-5H2,1-3H3 |
| InChIKey | UAMNBPZNOKNBMS-UHFFFAOYSA-N |
| XLogP | 3.72 |
| TPSA | 31.35 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 257.33 |
| LogP ≤ 5 | 3.72 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine?
The IUPAC name of 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine (CID 175907027) is 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine.
What is the SMILES notation for 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine?
The canonical SMILES for 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine is CCOc1cc(-c2ccccn2)c(OC)cc1CC.
What is the InChIKey of 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine?
The InChIKey is UAMNBPZNOKNBMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-4-12-10-16(18-3)13(11-15(12)19-5-2)14-8-6-7-9-17-14/h6-11H,4-5H2,1-3H3.
What are the key properties of 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine?
2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine has a molecular weight of 257.33 g/mol, XLogP of 3.72, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethoxy-4-ethyl-2-methoxyphenyl)pyridine is sourced from PubChem (CID 175907027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).