About 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine
2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine (PubChem CID 43721905) has the molecular formula C18H18N2O
and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine.
Molecular Properties
| Compound Name | 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine |
| PubChem CID | 43721905 |
| Molecular Formula | C18H18N2O |
| Molecular Weight | 278.36 g/mol |
| Exact Mass | 278.14 |
| IUPAC Name | 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine |
| SMILES | COc1ncccc1NC(C)c1ccc2ccccc2c1 |
| InChI | InChI=1S/C18H18N2O/c1-13(20-17-8-5-11-19-18(17)21-2)15-10-9-14-6-3-4-7-16(14)12-15/h3-13,20H,1-2H3 |
| InChIKey | WATDHDLOZFYNBQ-UHFFFAOYSA-N |
| XLogP | 4.42 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 278.36 |
| LogP ≤ 5 | 4.42 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine?
The IUPAC name of 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine (CID 43721905) is 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine.
What is the SMILES notation for 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine?
The canonical SMILES for 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine is COc1ncccc1NC(C)c1ccc2ccccc2c1.
What is the InChIKey of 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine?
The InChIKey is WATDHDLOZFYNBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13(20-17-8-5-11-19-18(17)21-2)15-10-9-14-6-3-4-7-16(14)12-15/h3-13,20H,1-2H3.
What are the key properties of 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine?
2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine has a molecular weight of 278.36 g/mol, XLogP of 4.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1-naphthalen-2-ylethyl)pyridin-3-amine is sourced from PubChem (CID 43721905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).