About 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine
5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine (PubChem CID 103583765) has the molecular formula C11H5BrCl2FNO
and a molecular weight of 336.98 g/mol. Its IUPAC name is 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine.
Molecular Properties
| Compound Name | 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine |
| PubChem CID | 103583765 |
| Molecular Formula | C11H5BrCl2FNO |
| Molecular Weight | 336.98 g/mol |
| Exact Mass | 334.89 |
| IUPAC Name | 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine |
| SMILES | Fc1c(Cl)cccc1Oc1ncc(Br)cc1Cl |
| InChI | InChI=1S/C11H5BrCl2FNO/c12-6-4-8(14)11(16-5-6)17-9-3-1-2-7(13)10(9)15/h1-5H |
| InChIKey | LEVDFEMXGDDZHK-UHFFFAOYSA-N |
| XLogP | 5.08 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 336.98 |
| LogP ≤ 5 | 5.08 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine?
The IUPAC name of 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine (CID 103583765) is 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine.
What is the SMILES notation for 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine?
The canonical SMILES for 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine is Fc1c(Cl)cccc1Oc1ncc(Br)cc1Cl.
What is the InChIKey of 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine?
The InChIKey is LEVDFEMXGDDZHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5BrCl2FNO/c12-6-4-8(14)11(16-5-6)17-9-3-1-2-7(13)10(9)15/h1-5H.
What are the key properties of 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine?
5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine has a molecular weight of 336.98 g/mol, XLogP of 5.08, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-2-(3-chloro-2-fluorophenoxy)pyridine is sourced from PubChem (CID 103583765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).