About 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine
6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine (PubChem CID 43262377) has the molecular formula C16H20N2O3
and a molecular weight of 288.35 g/mol. Its IUPAC name is 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine.
Molecular Properties
| Compound Name | 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine |
| PubChem CID | 43262377 |
| Molecular Formula | C16H20N2O3 |
| Molecular Weight | 288.35 g/mol |
| Exact Mass | 288.15 |
| IUPAC Name | 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine |
| SMILES | CCCOc1nc(OCc2cccc(OC)c2)ccc1N |
| InChI | InChI=1S/C16H20N2O3/c1-3-9-20-16-14(17)7-8-15(18-16)21-11-12-5-4-6-13(10-12)19-2/h4-8,10H,3,9,11,17H2,1-2H3 |
| InChIKey | OTWDIYSVPWKQKF-UHFFFAOYSA-N |
| XLogP | 3.04 |
| TPSA | 66.60 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 288.35 |
| LogP ≤ 5 | 3.04 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine?
The IUPAC name of 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine (CID 43262377) is 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine.
What is the SMILES notation for 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine?
The canonical SMILES for 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine is CCCOc1nc(OCc2cccc(OC)c2)ccc1N.
What is the InChIKey of 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine?
The InChIKey is OTWDIYSVPWKQKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-3-9-20-16-14(17)7-8-15(18-16)21-11-12-5-4-6-13(10-12)19-2/h4-8,10H,3,9,11,17H2,1-2H3.
What are the key properties of 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine?
6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine has a molecular weight of 288.35 g/mol, XLogP of 3.04, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-methoxyphenyl)methoxy]-2-propoxypyridin-3-amine is sourced from PubChem (CID 43262377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).