About 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine
2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine (PubChem CID 118905530) has the molecular formula C15H18N2O2
and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine.
Molecular Properties
| Compound Name | 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine |
| PubChem CID | 118905530 |
| Molecular Formula | C15H18N2O2 |
| Molecular Weight | 258.32 g/mol |
| Exact Mass | 258.14 |
| IUPAC Name | 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine |
| SMILES | COc1ccc(OCc2ccccc2)c(CCN)n1 |
| InChI | InChI=1S/C15H18N2O2/c1-18-15-8-7-14(13(17-15)9-10-16)19-11-12-5-3-2-4-6-12/h2-8H,9-11,16H2,1H3 |
| InChIKey | YUEKXGBGSWJIMU-UHFFFAOYSA-N |
| XLogP | 2.17 |
| TPSA | 57.37 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.32 |
| LogP ≤ 5 | 2.17 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine?
The IUPAC name of 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine (CID 118905530) is 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine.
What is the SMILES notation for 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine?
The canonical SMILES for 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine is COc1ccc(OCc2ccccc2)c(CCN)n1.
What is the InChIKey of 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine?
The InChIKey is YUEKXGBGSWJIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-18-15-8-7-14(13(17-15)9-10-16)19-11-12-5-3-2-4-6-12/h2-8H,9-11,16H2,1H3.
What are the key properties of 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine?
2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine has a molecular weight of 258.32 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-3-phenylmethoxy-2-pyridinyl)ethanamine is sourced from PubChem (CID 118905530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).