About 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine
6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine (PubChem CID 103946830) has the molecular formula C11H15FN2O
and a molecular weight of 210.25 g/mol. Its IUPAC name is 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine.
Molecular Properties
| Compound Name | 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine |
| PubChem CID | 103946830 |
| Molecular Formula | C11H15FN2O |
| Molecular Weight | 210.25 g/mol |
| Exact Mass | 210.12 |
| IUPAC Name | 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine |
| SMILES | CC1CC(Nc2ccc(F)nc2)CCO1 |
| InChI | InChI=1S/C11H15FN2O/c1-8-6-9(4-5-15-8)14-10-2-3-11(12)13-7-10/h2-3,7-9,14H,4-6H2,1H3 |
| InChIKey | WKDKGXWSXPBHPD-UHFFFAOYSA-N |
| XLogP | 2.20 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 210.25 |
| LogP ≤ 5 | 2.20 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine?
The IUPAC name of 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine (CID 103946830) is 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine.
What is the SMILES notation for 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine?
The canonical SMILES for 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine is CC1CC(Nc2ccc(F)nc2)CCO1.
What is the InChIKey of 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine?
The InChIKey is WKDKGXWSXPBHPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-8-6-9(4-5-15-8)14-10-2-3-11(12)13-7-10/h2-3,7-9,14H,4-6H2,1H3.
What are the key properties of 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine?
6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine has a molecular weight of 210.25 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(2-methyloxan-4-yl)pyridin-3-amine is sourced from PubChem (CID 103946830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).