About 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine
3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine (PubChem CID 130388822) has the molecular formula C19H17N
and a molecular weight of 259.35 g/mol. Its IUPAC name is 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine.
Molecular Properties
| Compound Name | 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine |
| PubChem CID | 130388822 |
| Molecular Formula | C19H17N |
| Molecular Weight | 259.35 g/mol |
| Exact Mass | 259.14 |
| IUPAC Name | 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine |
| SMILES | Cc1ccc(-c2cc(C)cc(-c3cccnc3)c2)cc1 |
| InChI | InChI=1S/C19H17N/c1-14-5-7-16(8-6-14)18-10-15(2)11-19(12-18)17-4-3-9-20-13-17/h3-13H,1-2H3 |
| InChIKey | KZJJECSOAXKTGX-UHFFFAOYSA-N |
| XLogP | 5.03 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 259.35 |
| LogP ≤ 5 | 5.03 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Analyze 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine?
The IUPAC name of 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine (CID 130388822) is 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine.
What is the SMILES notation for 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine?
The canonical SMILES for 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine is Cc1ccc(-c2cc(C)cc(-c3cccnc3)c2)cc1.
What is the InChIKey of 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine?
The InChIKey is KZJJECSOAXKTGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N/c1-14-5-7-16(8-6-14)18-10-15(2)11-19(12-18)17-4-3-9-20-13-17/h3-13H,1-2H3.
What are the key properties of 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine?
3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine has a molecular weight of 259.35 g/mol, XLogP of 5.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine is sourced from PubChem (CID 130388822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).