About N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine
N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine (PubChem CID 103932113) has the molecular formula C12H14N2O2
and a molecular weight of 218.26 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine.
Molecular Properties
| Compound Name | N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine |
| PubChem CID | 103932113 |
| Molecular Formula | C12H14N2O2 |
| Molecular Weight | 218.26 g/mol |
| Exact Mass | 218.11 |
| IUPAC Name | N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine |
| SMILES | COc1ccc(NC(C)c2ccco2)nc1 |
| InChI | InChI=1S/C12H14N2O2/c1-9(11-4-3-7-16-11)14-12-6-5-10(15-2)8-13-12/h3-9H,1-2H3,(H,13,14) |
| InChIKey | ZNCBUHACTSDGHE-UHFFFAOYSA-N |
| XLogP | 2.86 |
| TPSA | 47.29 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 218.26 |
| LogP ≤ 5 | 2.86 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine (CID 103932113) is N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine is COc1ccc(NC(C)c2ccco2)nc1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine?
The InChIKey is ZNCBUHACTSDGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-9(11-4-3-7-16-11)14-12-6-5-10(15-2)8-13-12/h3-9H,1-2H3,(H,13,14).
What are the key properties of N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine?
N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine has a molecular weight of 218.26 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-5-methoxypyridin-2-amine is sourced from PubChem (CID 103932113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).