About 4-(2-cyclopentylethoxy)pyridine
4-(2-cyclopentylethoxy)pyridine (PubChem CID 91320777) has the molecular formula C12H17NO
and a molecular weight of 191.27 g/mol. Its IUPAC name is 4-(2-cyclopentylethoxy)pyridine.
Molecular Properties
| Compound Name | 4-(2-cyclopentylethoxy)pyridine |
| PubChem CID | 91320777 |
| Molecular Formula | C12H17NO |
| Molecular Weight | 191.27 g/mol |
| Exact Mass | 191.13 |
| IUPAC Name | 4-(2-cyclopentylethoxy)pyridine |
| SMILES | c1cc(OCCC2CCCC2)ccn1 |
| InChI | InChI=1S/C12H17NO/c1-2-4-11(3-1)7-10-14-12-5-8-13-9-6-12/h5-6,8-9,11H,1-4,7,10H2 |
| InChIKey | IBBLAIJQPMFBKU-UHFFFAOYSA-N |
| XLogP | 3.04 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 191.27 |
| LogP ≤ 5 | 3.04 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-(2-cyclopentylethoxy)pyridine?
The IUPAC name of 4-(2-cyclopentylethoxy)pyridine (CID 91320777) is 4-(2-cyclopentylethoxy)pyridine.
What is the SMILES notation for 4-(2-cyclopentylethoxy)pyridine?
The canonical SMILES for 4-(2-cyclopentylethoxy)pyridine is c1cc(OCCC2CCCC2)ccn1.
What is the InChIKey of 4-(2-cyclopentylethoxy)pyridine?
The InChIKey is IBBLAIJQPMFBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-2-4-11(3-1)7-10-14-12-5-8-13-9-6-12/h5-6,8-9,11H,1-4,7,10H2.
What are the key properties of 4-(2-cyclopentylethoxy)pyridine?
4-(2-cyclopentylethoxy)pyridine has a molecular weight of 191.27 g/mol, XLogP of 3.04, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopentylethoxy)pyridine is sourced from PubChem (CID 91320777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).