About 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine
6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine (PubChem CID 55140098) has the molecular formula C14H14F2N2
and a molecular weight of 248.28 g/mol. Its IUPAC name is 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine.
Molecular Properties
| Compound Name | 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine |
| PubChem CID | 55140098 |
| Molecular Formula | C14H14F2N2 |
| Molecular Weight | 248.28 g/mol |
| Exact Mass | 248.11 |
| IUPAC Name | 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine |
| SMILES | CC(c1ccccc1F)N(C)c1cccc(F)n1 |
| InChI | InChI=1S/C14H14F2N2/c1-10(11-6-3-4-7-12(11)15)18(2)14-9-5-8-13(16)17-14/h3-10H,1-2H3 |
| InChIKey | RGWCXXJVTWGQQV-UHFFFAOYSA-N |
| XLogP | 3.56 |
| TPSA | 16.13 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 248.28 |
| LogP ≤ 5 | 3.56 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine (CID 55140098) is 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine is CC(c1ccccc1F)N(C)c1cccc(F)n1.
What is the InChIKey of 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine?
The InChIKey is RGWCXXJVTWGQQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2/c1-10(11-6-3-4-7-12(11)15)18(2)14-9-5-8-13(16)17-14/h3-10H,1-2H3.
What are the key properties of 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine?
6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine has a molecular weight of 248.28 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 55140098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).