About 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine
3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine (PubChem CID 62464422) has the molecular formula C14H16N2O2
and a molecular weight of 244.29 g/mol. Its IUPAC name is 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine.
Molecular Properties
| Compound Name | 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine |
| PubChem CID | 62464422 |
| Molecular Formula | C14H16N2O2 |
| Molecular Weight | 244.29 g/mol |
| Exact Mass | 244.12 |
| IUPAC Name | 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine |
| SMILES | CNc1ncccc1COc1ccccc1OC |
| InChI | InChI=1S/C14H16N2O2/c1-15-14-11(6-5-9-16-14)10-18-13-8-4-3-7-12(13)17-2/h3-9H,10H2,1-2H3,(H,15,16) |
| InChIKey | VVHMXZCNRBNMSZ-UHFFFAOYSA-N |
| XLogP | 2.71 |
| TPSA | 43.38 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 244.29 |
| LogP ≤ 5 | 2.71 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine (CID 62464422) is 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine is CNc1ncccc1COc1ccccc1OC.
What is the InChIKey of 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine?
The InChIKey is VVHMXZCNRBNMSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-15-14-11(6-5-9-16-14)10-18-13-8-4-3-7-12(13)17-2/h3-9H,10H2,1-2H3,(H,15,16).
What are the key properties of 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine?
3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine has a molecular weight of 244.29 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxyphenoxy)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 62464422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).