About 5-bromo-2-(4-phenylphenyl)pyridine
5-bromo-2-(4-phenylphenyl)pyridine (PubChem CID 59156304) has the molecular formula C17H12BrN
and a molecular weight of 310.19 g/mol. Its IUPAC name is 5-bromo-2-(4-phenylphenyl)pyridine.
Molecular Properties
| Compound Name | 5-bromo-2-(4-phenylphenyl)pyridine |
| PubChem CID | 59156304 |
| Molecular Formula | C17H12BrN |
| Molecular Weight | 310.19 g/mol |
| Exact Mass | 309.02 |
| IUPAC Name | 5-bromo-2-(4-phenylphenyl)pyridine |
| SMILES | Brc1ccc(-c2ccc(-c3ccccc3)cc2)nc1 |
| InChI | InChI=1S/C17H12BrN/c18-16-10-11-17(19-12-16)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12H |
| InChIKey | KWYBUTIQLSOZAJ-UHFFFAOYSA-N |
| XLogP | 5.18 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 310.19 |
| LogP ≤ 5 | 5.18 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 5-bromo-2-(4-phenylphenyl)pyridine?
The IUPAC name of 5-bromo-2-(4-phenylphenyl)pyridine (CID 59156304) is 5-bromo-2-(4-phenylphenyl)pyridine.
What is the SMILES notation for 5-bromo-2-(4-phenylphenyl)pyridine?
The canonical SMILES for 5-bromo-2-(4-phenylphenyl)pyridine is Brc1ccc(-c2ccc(-c3ccccc3)cc2)nc1.
What is the InChIKey of 5-bromo-2-(4-phenylphenyl)pyridine?
The InChIKey is KWYBUTIQLSOZAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12BrN/c18-16-10-11-17(19-12-16)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12H.
What are the key properties of 5-bromo-2-(4-phenylphenyl)pyridine?
5-bromo-2-(4-phenylphenyl)pyridine has a molecular weight of 310.19 g/mol, XLogP of 5.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(4-phenylphenyl)pyridine is sourced from PubChem (CID 59156304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).