About 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine
6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine (PubChem CID 107637214) has the molecular formula C11H7Br2FN2
and a molecular weight of 346.00 g/mol. Its IUPAC name is 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine.
Molecular Properties
| Compound Name | 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine |
| PubChem CID | 107637214 |
| Molecular Formula | C11H7Br2FN2 |
| Molecular Weight | 346.00 g/mol |
| Exact Mass | 343.90 |
| IUPAC Name | 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine |
| SMILES | Fc1ccc(Br)c(Nc2cccc(Br)n2)c1 |
| InChI | InChI=1S/C11H7Br2FN2/c12-8-5-4-7(14)6-9(8)15-11-3-1-2-10(13)16-11/h1-6H,(H,15,16) |
| InChIKey | JRDNGMGEXHPYPC-UHFFFAOYSA-N |
| XLogP | 4.49 |
| TPSA | 24.92 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 346.00 |
| LogP ≤ 5 | 4.49 |
| H-Bond Donors ≤ 5 | 1 |
| 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-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine?
The IUPAC name of 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine (CID 107637214) is 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine.
What is the SMILES notation for 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine?
The canonical SMILES for 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine is Fc1ccc(Br)c(Nc2cccc(Br)n2)c1.
What is the InChIKey of 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine?
The InChIKey is JRDNGMGEXHPYPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Br2FN2/c12-8-5-4-7(14)6-9(8)15-11-3-1-2-10(13)16-11/h1-6H,(H,15,16).
What are the key properties of 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine?
6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine has a molecular weight of 346.00 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(2-bromo-5-fluorophenyl)pyridin-2-amine is sourced from PubChem (CID 107637214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).