About 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine
5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine (PubChem CID 65164603) has the molecular formula C14H22N2O
and a molecular weight of 234.34 g/mol. Its IUPAC name is 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine.
Molecular Properties
| Compound Name | 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine |
| PubChem CID | 65164603 |
| Molecular Formula | C14H22N2O |
| Molecular Weight | 234.34 g/mol |
| Exact Mass | 234.17 |
| IUPAC Name | 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine |
| SMILES | NC(CCCC1CCCO1)Cc1ccncc1 |
| InChI | InChI=1S/C14H22N2O/c15-13(11-12-6-8-16-9-7-12)3-1-4-14-5-2-10-17-14/h6-9,13-14H,1-5,10-11,15H2 |
| InChIKey | QICMTOUPQFFELP-UHFFFAOYSA-N |
| XLogP | 2.30 |
| TPSA | 48.14 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 234.34 |
| LogP ≤ 5 | 2.30 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine?
The IUPAC name of 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine (CID 65164603) is 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine.
What is the SMILES notation for 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine?
The canonical SMILES for 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine is NC(CCCC1CCCO1)Cc1ccncc1.
What is the InChIKey of 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine?
The InChIKey is QICMTOUPQFFELP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c15-13(11-12-6-8-16-9-7-12)3-1-4-14-5-2-10-17-14/h6-9,13-14H,1-5,10-11,15H2.
What are the key properties of 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine?
5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine has a molecular weight of 234.34 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine is sourced from PubChem (CID 65164603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).