About 2-(oxan-4-yl)pyridin-4-amine
2-(oxan-4-yl)pyridin-4-amine (PubChem CID 58962705) has the molecular formula C10H14N2O
and a molecular weight of 178.24 g/mol. Its IUPAC name is 2-(oxan-4-yl)pyridin-4-amine.
Molecular Properties
| Compound Name | 2-(oxan-4-yl)pyridin-4-amine |
| PubChem CID | 58962705 |
| Molecular Formula | C10H14N2O |
| Molecular Weight | 178.24 g/mol |
| Exact Mass | 178.11 |
| IUPAC Name | 2-(oxan-4-yl)pyridin-4-amine |
| SMILES | Nc1ccnc(C2CCOCC2)c1 |
| InChI | InChI=1S/C10H14N2O/c11-9-1-4-12-10(7-9)8-2-5-13-6-3-8/h1,4,7-8H,2-3,5-6H2,(H2,11,12) |
| InChIKey | OWYLWJWVTYHWJP-UHFFFAOYSA-N |
| XLogP | 1.56 |
| TPSA | 48.14 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 178.24 |
| LogP ≤ 5 | 1.56 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(oxan-4-yl)pyridin-4-amine?
The IUPAC name of 2-(oxan-4-yl)pyridin-4-amine (CID 58962705) is 2-(oxan-4-yl)pyridin-4-amine.
What is the SMILES notation for 2-(oxan-4-yl)pyridin-4-amine?
The canonical SMILES for 2-(oxan-4-yl)pyridin-4-amine is Nc1ccnc(C2CCOCC2)c1.
What is the InChIKey of 2-(oxan-4-yl)pyridin-4-amine?
The InChIKey is OWYLWJWVTYHWJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c11-9-1-4-12-10(7-9)8-2-5-13-6-3-8/h1,4,7-8H,2-3,5-6H2,(H2,11,12).
What are the key properties of 2-(oxan-4-yl)pyridin-4-amine?
2-(oxan-4-yl)pyridin-4-amine has a molecular weight of 178.24 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxan-4-yl)pyridin-4-amine is sourced from PubChem (CID 58962705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).