About 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine
2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine (PubChem CID 144553934) has the molecular formula C16H13N3
and a molecular weight of 247.30 g/mol. Its IUPAC name is 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine.
Molecular Properties
| Compound Name | 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine |
| PubChem CID | 144553934 |
| Molecular Formula | C16H13N3 |
| Molecular Weight | 247.30 g/mol |
| Exact Mass | 247.11 |
| IUPAC Name | 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine |
| SMILES | Cc1cc(-c2ccccn2)cc(-c2cnccn2)c1 |
| InChI | InChI=1S/C16H13N3/c1-12-8-13(15-4-2-3-5-18-15)10-14(9-12)16-11-17-6-7-19-16/h2-11H,1H3 |
| InChIKey | XZFOYLBUJYUYLY-UHFFFAOYSA-N |
| XLogP | 3.51 |
| TPSA | 38.67 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 247.30 |
| LogP ≤ 5 | 3.51 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine?
The IUPAC name of 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine (CID 144553934) is 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine.
What is the SMILES notation for 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine?
The canonical SMILES for 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine is Cc1cc(-c2ccccn2)cc(-c2cnccn2)c1.
What is the InChIKey of 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine?
The InChIKey is XZFOYLBUJYUYLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3/c1-12-8-13(15-4-2-3-5-18-15)10-14(9-12)16-11-17-6-7-19-16/h2-11H,1H3.
What are the key properties of 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine?
2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine has a molecular weight of 247.30 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-5-pyridin-2-ylphenyl)pyrazine is sourced from PubChem (CID 144553934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).