About 2-(2-propan-2-ylphenyl)pyridine
2-(2-propan-2-ylphenyl)pyridine (PubChem CID 55253137) has the molecular formula C14H15N
and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-(2-propan-2-ylphenyl)pyridine.
Molecular Properties
| Compound Name | 2-(2-propan-2-ylphenyl)pyridine |
| PubChem CID | 55253137 |
| Molecular Formula | C14H15N |
| Molecular Weight | 197.28 g/mol |
| Exact Mass | 197.12 |
| IUPAC Name | 2-(2-propan-2-ylphenyl)pyridine |
| SMILES | CC(C)c1ccccc1-c1ccccn1 |
| InChI | InChI=1S/C14H15N/c1-11(2)12-7-3-4-8-13(12)14-9-5-6-10-15-14/h3-11H,1-2H3 |
| InChIKey | IBJXBKCBXIGQRN-UHFFFAOYSA-N |
| XLogP | 3.87 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 197.28 |
| LogP ≤ 5 | 3.87 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Analyze 2-(2-propan-2-ylphenyl)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 2-(2-propan-2-ylphenyl)pyridine?
The IUPAC name of 2-(2-propan-2-ylphenyl)pyridine (CID 55253137) is 2-(2-propan-2-ylphenyl)pyridine.
What is the SMILES notation for 2-(2-propan-2-ylphenyl)pyridine?
The canonical SMILES for 2-(2-propan-2-ylphenyl)pyridine is CC(C)c1ccccc1-c1ccccn1.
What is the InChIKey of 2-(2-propan-2-ylphenyl)pyridine?
The InChIKey is IBJXBKCBXIGQRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N/c1-11(2)12-7-3-4-8-13(12)14-9-5-6-10-15-14/h3-11H,1-2H3.
What are the key properties of 2-(2-propan-2-ylphenyl)pyridine?
2-(2-propan-2-ylphenyl)pyridine has a molecular weight of 197.28 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-ylphenyl)pyridine is sourced from PubChem (CID 55253137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).