About 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine
1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine (PubChem CID 55120655) has the molecular formula C15H18N2O
and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine.
Molecular Properties
| Compound Name | 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine |
| PubChem CID | 55120655 |
| Molecular Formula | C15H18N2O |
| Molecular Weight | 242.32 g/mol |
| Exact Mass | 242.14 |
| IUPAC Name | 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine |
| SMILES | CCOc1ccccc1C(NC)c1ccccn1 |
| InChI | InChI=1S/C15H18N2O/c1-3-18-14-10-5-4-8-12(14)15(16-2)13-9-6-7-11-17-13/h4-11,15-16H,3H2,1-2H3 |
| InChIKey | WANXZIYZFGIRCV-UHFFFAOYSA-N |
| XLogP | 2.79 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 242.32 |
| LogP ≤ 5 | 2.79 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine?
The IUPAC name of 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine (CID 55120655) is 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine.
What is the SMILES notation for 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine?
The canonical SMILES for 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine is CCOc1ccccc1C(NC)c1ccccn1.
What is the InChIKey of 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine?
The InChIKey is WANXZIYZFGIRCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-3-18-14-10-5-4-8-12(14)15(16-2)13-9-6-7-11-17-13/h4-11,15-16H,3H2,1-2H3.
What are the key properties of 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine?
1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine has a molecular weight of 242.32 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-N-methyl-1-pyridin-2-ylmethanamine is sourced from PubChem (CID 55120655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).