About 3-(cyclopropylmethoxy)-4-methoxypyridine
3-(cyclopropylmethoxy)-4-methoxypyridine (PubChem CID 150318193) has the molecular formula C10H13NO2
and a molecular weight of 179.22 g/mol. Its IUPAC name is 3-(cyclopropylmethoxy)-4-methoxypyridine.
Molecular Properties
| Compound Name | 3-(cyclopropylmethoxy)-4-methoxypyridine |
| PubChem CID | 150318193 |
| Molecular Formula | C10H13NO2 |
| Molecular Weight | 179.22 g/mol |
| Exact Mass | 179.09 |
| IUPAC Name | 3-(cyclopropylmethoxy)-4-methoxypyridine |
| SMILES | COc1ccncc1OCC1CC1 |
| InChI | InChI=1S/C10H13NO2/c1-12-9-4-5-11-6-10(9)13-7-8-2-3-8/h4-6,8H,2-3,7H2,1H3 |
| InChIKey | GNAZCTZAHPNZTD-UHFFFAOYSA-N |
| XLogP | 1.88 |
| TPSA | 31.35 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 179.22 |
| LogP ≤ 5 | 1.88 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-(cyclopropylmethoxy)-4-methoxypyridine?
The IUPAC name of 3-(cyclopropylmethoxy)-4-methoxypyridine (CID 150318193) is 3-(cyclopropylmethoxy)-4-methoxypyridine.
What is the SMILES notation for 3-(cyclopropylmethoxy)-4-methoxypyridine?
The canonical SMILES for 3-(cyclopropylmethoxy)-4-methoxypyridine is COc1ccncc1OCC1CC1.
What is the InChIKey of 3-(cyclopropylmethoxy)-4-methoxypyridine?
The InChIKey is GNAZCTZAHPNZTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-12-9-4-5-11-6-10(9)13-7-8-2-3-8/h4-6,8H,2-3,7H2,1H3.
What are the key properties of 3-(cyclopropylmethoxy)-4-methoxypyridine?
3-(cyclopropylmethoxy)-4-methoxypyridine has a molecular weight of 179.22 g/mol, XLogP of 1.88, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethoxy)-4-methoxypyridine is sourced from PubChem (CID 150318193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).