About 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine
5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine (PubChem CID 104536802) has the molecular formula C10H16N2O2
and a molecular weight of 196.25 g/mol. Its IUPAC name is 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine.
Molecular Properties
| Compound Name | 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine |
| PubChem CID | 104536802 |
| Molecular Formula | C10H16N2O2 |
| Molecular Weight | 196.25 g/mol |
| Exact Mass | 196.12 |
| IUPAC Name | 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine |
| SMILES | CNc1cncc(OC(C)COC)c1 |
| InChI | InChI=1S/C10H16N2O2/c1-8(7-13-3)14-10-4-9(11-2)5-12-6-10/h4-6,8,11H,7H2,1-3H3 |
| InChIKey | XBJVJVYWFXFMGU-UHFFFAOYSA-N |
| XLogP | 1.54 |
| TPSA | 43.38 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 196.25 |
| LogP ≤ 5 | 1.54 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine?
The IUPAC name of 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine (CID 104536802) is 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine.
What is the SMILES notation for 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine?
The canonical SMILES for 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine is CNc1cncc(OC(C)COC)c1.
What is the InChIKey of 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine?
The InChIKey is XBJVJVYWFXFMGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-8(7-13-3)14-10-4-9(11-2)5-12-6-10/h4-6,8,11H,7H2,1-3H3.
What are the key properties of 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine?
5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine has a molecular weight of 196.25 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methoxypropan-2-yloxy)-N-methylpyridin-3-amine is sourced from PubChem (CID 104536802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).