About 5-methoxy-2-pyridin-3-ylindazole
5-methoxy-2-pyridin-3-ylindazole (PubChem CID 121320237) has the molecular formula C13H11N3O
and a molecular weight of 225.25 g/mol. Its IUPAC name is 5-methoxy-2-pyridin-3-ylindazole.
Molecular Properties
| Compound Name | 5-methoxy-2-pyridin-3-ylindazole |
| PubChem CID | 121320237 |
| Molecular Formula | C13H11N3O |
| Molecular Weight | 225.25 g/mol |
| Exact Mass | 225.09 |
| IUPAC Name | 5-methoxy-2-pyridin-3-ylindazole |
| SMILES | COc1ccc2nn(-c3cccnc3)cc2c1 |
| InChI | InChI=1S/C13H11N3O/c1-17-12-4-5-13-10(7-12)9-16(15-13)11-3-2-6-14-8-11/h2-9H,1H3 |
| InChIKey | ODLPFFVNFPPXRW-UHFFFAOYSA-N |
| XLogP | 2.43 |
| TPSA | 39.94 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 225.25 |
| LogP ≤ 5 | 2.43 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 5-methoxy-2-pyridin-3-ylindazole?
The IUPAC name of 5-methoxy-2-pyridin-3-ylindazole (CID 121320237) is 5-methoxy-2-pyridin-3-ylindazole.
What is the SMILES notation for 5-methoxy-2-pyridin-3-ylindazole?
The canonical SMILES for 5-methoxy-2-pyridin-3-ylindazole is COc1ccc2nn(-c3cccnc3)cc2c1.
What is the InChIKey of 5-methoxy-2-pyridin-3-ylindazole?
The InChIKey is ODLPFFVNFPPXRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-17-12-4-5-13-10(7-12)9-16(15-13)11-3-2-6-14-8-11/h2-9H,1H3.
What are the key properties of 5-methoxy-2-pyridin-3-ylindazole?
5-methoxy-2-pyridin-3-ylindazole has a molecular weight of 225.25 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-pyridin-3-ylindazole is sourced from PubChem (CID 121320237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).