About 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine
3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine (PubChem CID 117063213) has the molecular formula C12H19N3O2
and a molecular weight of 237.30 g/mol. Its IUPAC name is 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine.
Molecular Properties
| Compound Name | 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine |
| PubChem CID | 117063213 |
| Molecular Formula | C12H19N3O2 |
| Molecular Weight | 237.30 g/mol |
| Exact Mass | 237.15 |
| IUPAC Name | 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine |
| SMILES | COc1ccc(OCC2CCCCN2C)nn1 |
| InChI | InChI=1S/C12H19N3O2/c1-15-8-4-3-5-10(15)9-17-12-7-6-11(16-2)13-14-12/h6-7,10H,3-5,8-9H2,1-2H3 |
| InChIKey | QZOSWTAYNSVLOA-UHFFFAOYSA-N |
| XLogP | 1.35 |
| TPSA | 47.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 237.30 |
| LogP ≤ 5 | 1.35 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine?
The IUPAC name of 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine (CID 117063213) is 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine.
What is the SMILES notation for 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine?
The canonical SMILES for 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine is COc1ccc(OCC2CCCCN2C)nn1.
What is the InChIKey of 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine?
The InChIKey is QZOSWTAYNSVLOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-15-8-4-3-5-10(15)9-17-12-7-6-11(16-2)13-14-12/h6-7,10H,3-5,8-9H2,1-2H3.
What are the key properties of 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine?
3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine has a molecular weight of 237.30 g/mol, XLogP of 1.35, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine is sourced from PubChem (CID 117063213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).