About 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine
2-[(4-ethylphenoxy)methyl]-6-methoxypyridine (PubChem CID 64763644) has the molecular formula C15H17NO2
and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine.
Molecular Properties
| Compound Name | 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine |
| PubChem CID | 64763644 |
| Molecular Formula | C15H17NO2 |
| Molecular Weight | 243.31 g/mol |
| Exact Mass | 243.13 |
| IUPAC Name | 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine |
| SMILES | CCc1ccc(OCc2cccc(OC)n2)cc1 |
| InChI | InChI=1S/C15H17NO2/c1-3-12-7-9-14(10-8-12)18-11-13-5-4-6-15(16-13)17-2/h4-10H,3,11H2,1-2H3 |
| InChIKey | ZCZGHTVDAJGWAB-UHFFFAOYSA-N |
| XLogP | 3.23 |
| TPSA | 31.35 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 243.31 |
| LogP ≤ 5 | 3.23 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine?
The IUPAC name of 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine (CID 64763644) is 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine.
What is the SMILES notation for 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine?
The canonical SMILES for 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine is CCc1ccc(OCc2cccc(OC)n2)cc1.
What is the InChIKey of 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine?
The InChIKey is ZCZGHTVDAJGWAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-3-12-7-9-14(10-8-12)18-11-13-5-4-6-15(16-13)17-2/h4-10H,3,11H2,1-2H3.
What are the key properties of 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine?
2-[(4-ethylphenoxy)methyl]-6-methoxypyridine has a molecular weight of 243.31 g/mol, XLogP of 3.23, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylphenoxy)methyl]-6-methoxypyridine is sourced from PubChem (CID 64763644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).