About 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine
2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine (PubChem CID 115464887) has the molecular formula C19H19NO
and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine.
Molecular Properties
| Compound Name | 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine |
| PubChem CID | 115464887 |
| Molecular Formula | C19H19NO |
| Molecular Weight | 277.37 g/mol |
| Exact Mass | 277.15 |
| IUPAC Name | 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine |
| SMILES | NCCc1ccccc1COc1ccc2ccccc2c1 |
| InChI | InChI=1S/C19H19NO/c20-12-11-16-6-2-4-8-18(16)14-21-19-10-9-15-5-1-3-7-17(15)13-19/h1-10,13H,11-12,14,20H2 |
| InChIKey | MLODKCPNQPKOKT-UHFFFAOYSA-N |
| XLogP | 3.92 |
| TPSA | 35.25 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 277.37 |
| LogP ≤ 5 | 3.92 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine?
The IUPAC name of 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine (CID 115464887) is 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine.
What is the SMILES notation for 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine?
The canonical SMILES for 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine is NCCc1ccccc1COc1ccc2ccccc2c1.
What is the InChIKey of 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine?
The InChIKey is MLODKCPNQPKOKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c20-12-11-16-6-2-4-8-18(16)14-21-19-10-9-15-5-1-3-7-17(15)13-19/h1-10,13H,11-12,14,20H2.
What are the key properties of 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine?
2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine has a molecular weight of 277.37 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(naphthalen-2-yloxymethyl)phenyl]ethanamine is sourced from PubChem (CID 115464887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).