About 5-methoxy-2-pyridin-2-ylpyridine
5-methoxy-2-pyridin-2-ylpyridine (PubChem CID 604153) has the molecular formula C11H10N2O
and a molecular weight of 186.21 g/mol. Its IUPAC name is 5-methoxy-2-pyridin-2-ylpyridine.
Molecular Properties
| Compound Name | 5-methoxy-2-pyridin-2-ylpyridine |
| PubChem CID | 604153 |
| Molecular Formula | C11H10N2O |
| Molecular Weight | 186.21 g/mol |
| Exact Mass | 186.08 |
| IUPAC Name | 5-methoxy-2-pyridin-2-ylpyridine |
| SMILES | COc1ccc(-c2ccccn2)nc1 |
| InChI | InChI=1S/C11H10N2O/c1-14-9-5-6-11(13-8-9)10-4-2-3-7-12-10/h2-8H,1H3 |
| InChIKey | HIIBEBQOXYIXJP-UHFFFAOYSA-N |
| XLogP | 2.15 |
| TPSA | 35.01 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 186.21 |
| LogP ≤ 5 | 2.15 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5-methoxy-2-pyridin-2-ylpyridine?
The IUPAC name of 5-methoxy-2-pyridin-2-ylpyridine (CID 604153) is 5-methoxy-2-pyridin-2-ylpyridine.
What is the SMILES notation for 5-methoxy-2-pyridin-2-ylpyridine?
The canonical SMILES for 5-methoxy-2-pyridin-2-ylpyridine is COc1ccc(-c2ccccn2)nc1.
What is the InChIKey of 5-methoxy-2-pyridin-2-ylpyridine?
The InChIKey is HIIBEBQOXYIXJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c1-14-9-5-6-11(13-8-9)10-4-2-3-7-12-10/h2-8H,1H3.
What are the key properties of 5-methoxy-2-pyridin-2-ylpyridine?
5-methoxy-2-pyridin-2-ylpyridine has a molecular weight of 186.21 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-pyridin-2-ylpyridine is sourced from PubChem (CID 604153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).