About 3-phenyl-2-pyridin-3-ylpyridine
3-phenyl-2-pyridin-3-ylpyridine (PubChem CID 140510629) has the molecular formula C16H12N2
and a molecular weight of 232.29 g/mol. Its IUPAC name is 3-phenyl-2-pyridin-3-ylpyridine.
Molecular Properties
| Compound Name | 3-phenyl-2-pyridin-3-ylpyridine |
| PubChem CID | 140510629 |
| Molecular Formula | C16H12N2 |
| Molecular Weight | 232.29 g/mol |
| Exact Mass | 232.10 |
| IUPAC Name | 3-phenyl-2-pyridin-3-ylpyridine |
| SMILES | c1ccc(-c2cccnc2-c2cccnc2)cc1 |
| InChI | InChI=1S/C16H12N2/c1-2-6-13(7-3-1)15-9-5-11-18-16(15)14-8-4-10-17-12-14/h1-12H |
| InChIKey | CAIABANCFFKLNY-UHFFFAOYSA-N |
| XLogP | 3.81 |
| TPSA | 25.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.29 |
| LogP ≤ 5 | 3.81 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-phenyl-2-pyridin-3-ylpyridine?
The IUPAC name of 3-phenyl-2-pyridin-3-ylpyridine (CID 140510629) is 3-phenyl-2-pyridin-3-ylpyridine.
What is the SMILES notation for 3-phenyl-2-pyridin-3-ylpyridine?
The canonical SMILES for 3-phenyl-2-pyridin-3-ylpyridine is c1ccc(-c2cccnc2-c2cccnc2)cc1.
What is the InChIKey of 3-phenyl-2-pyridin-3-ylpyridine?
The InChIKey is CAIABANCFFKLNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2/c1-2-6-13(7-3-1)15-9-5-11-18-16(15)14-8-4-10-17-12-14/h1-12H.
What are the key properties of 3-phenyl-2-pyridin-3-ylpyridine?
3-phenyl-2-pyridin-3-ylpyridine has a molecular weight of 232.29 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-2-pyridin-3-ylpyridine is sourced from PubChem (CID 140510629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).