About 5-chloro-2-(piperidin-4-ylmethoxy)pyridine
5-chloro-2-(piperidin-4-ylmethoxy)pyridine (PubChem CID 62348953) has the molecular formula C11H15ClN2O
and a molecular weight of 226.71 g/mol. Its IUPAC name is 5-chloro-2-(piperidin-4-ylmethoxy)pyridine.
Molecular Properties
| Compound Name | 5-chloro-2-(piperidin-4-ylmethoxy)pyridine |
| PubChem CID | 62348953 |
| Molecular Formula | C11H15ClN2O |
| Molecular Weight | 226.71 g/mol |
| Exact Mass | 226.09 |
| IUPAC Name | 5-chloro-2-(piperidin-4-ylmethoxy)pyridine |
| SMILES | Clc1ccc(OCC2CCNCC2)nc1 |
| InChI | InChI=1S/C11H15ClN2O/c12-10-1-2-11(14-7-10)15-8-9-3-5-13-6-4-9/h1-2,7,9,13H,3-6,8H2 |
| InChIKey | KKYPJULWOVHENQ-UHFFFAOYSA-N |
| XLogP | 2.11 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.71 |
| LogP ≤ 5 | 2.11 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5-chloro-2-(piperidin-4-ylmethoxy)pyridine?
The IUPAC name of 5-chloro-2-(piperidin-4-ylmethoxy)pyridine (CID 62348953) is 5-chloro-2-(piperidin-4-ylmethoxy)pyridine.
What is the SMILES notation for 5-chloro-2-(piperidin-4-ylmethoxy)pyridine?
The canonical SMILES for 5-chloro-2-(piperidin-4-ylmethoxy)pyridine is Clc1ccc(OCC2CCNCC2)nc1.
What is the InChIKey of 5-chloro-2-(piperidin-4-ylmethoxy)pyridine?
The InChIKey is KKYPJULWOVHENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O/c12-10-1-2-11(14-7-10)15-8-9-3-5-13-6-4-9/h1-2,7,9,13H,3-6,8H2.
What are the key properties of 5-chloro-2-(piperidin-4-ylmethoxy)pyridine?
5-chloro-2-(piperidin-4-ylmethoxy)pyridine has a molecular weight of 226.71 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(piperidin-4-ylmethoxy)pyridine is sourced from PubChem (CID 62348953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).