About 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine
3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine (PubChem CID 50978797) has the molecular formula C11H10FN3
and a molecular weight of 203.22 g/mol. Its IUPAC name is 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine.
Molecular Properties
| Compound Name | 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine |
| PubChem CID | 50978797 |
| Molecular Formula | C11H10FN3 |
| Molecular Weight | 203.22 g/mol |
| Exact Mass | 203.09 |
| IUPAC Name | 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine |
| SMILES | Cc1ccc(-c2ccnc(F)c2)c(N)n1 |
| InChI | InChI=1S/C11H10FN3/c1-7-2-3-9(11(13)15-7)8-4-5-14-10(12)6-8/h2-6H,1H3,(H2,13,15) |
| InChIKey | OSEHNVIPHWSOCO-UHFFFAOYSA-N |
| XLogP | 2.17 |
| TPSA | 51.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 203.22 |
| LogP ≤ 5 | 2.17 |
| 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 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine?
The IUPAC name of 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine (CID 50978797) is 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine.
What is the SMILES notation for 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine?
The canonical SMILES for 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine is Cc1ccc(-c2ccnc(F)c2)c(N)n1.
What is the InChIKey of 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine?
The InChIKey is OSEHNVIPHWSOCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3/c1-7-2-3-9(11(13)15-7)8-4-5-14-10(12)6-8/h2-6H,1H3,(H2,13,15).
What are the key properties of 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine?
3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine has a molecular weight of 203.22 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine is sourced from PubChem (CID 50978797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).