About 2-(2-phenyl-3-pyridinyl)pyrimidine
2-(2-phenyl-3-pyridinyl)pyrimidine (PubChem CID 58421043) has the molecular formula C15H11N3
and a molecular weight of 233.27 g/mol. Its IUPAC name is 2-(2-phenyl-3-pyridinyl)pyrimidine.
Molecular Properties
| Compound Name | 2-(2-phenyl-3-pyridinyl)pyrimidine |
| PubChem CID | 58421043 |
| Molecular Formula | C15H11N3 |
| Molecular Weight | 233.27 g/mol |
| Exact Mass | 233.10 |
| IUPAC Name | 2-(2-phenyl-3-pyridinyl)pyrimidine |
| SMILES | c1ccc(-c2ncccc2-c2ncccn2)cc1 |
| InChI | InChI=1S/C15H11N3/c1-2-6-12(7-3-1)14-13(8-4-9-16-14)15-17-10-5-11-18-15/h1-11H |
| InChIKey | XRDNGTYWVUOSAG-UHFFFAOYSA-N |
| XLogP | 3.21 |
| TPSA | 38.67 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 233.27 |
| LogP ≤ 5 | 3.21 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-phenyl-3-pyridinyl)pyrimidine?
The IUPAC name of 2-(2-phenyl-3-pyridinyl)pyrimidine (CID 58421043) is 2-(2-phenyl-3-pyridinyl)pyrimidine.
What is the SMILES notation for 2-(2-phenyl-3-pyridinyl)pyrimidine?
The canonical SMILES for 2-(2-phenyl-3-pyridinyl)pyrimidine is c1ccc(-c2ncccc2-c2ncccn2)cc1.
What is the InChIKey of 2-(2-phenyl-3-pyridinyl)pyrimidine?
The InChIKey is XRDNGTYWVUOSAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3/c1-2-6-12(7-3-1)14-13(8-4-9-16-14)15-17-10-5-11-18-15/h1-11H.
What are the key properties of 2-(2-phenyl-3-pyridinyl)pyrimidine?
2-(2-phenyl-3-pyridinyl)pyrimidine has a molecular weight of 233.27 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenyl-3-pyridinyl)pyrimidine is sourced from PubChem (CID 58421043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).