About 2-(4-methoxyphenyl)-5-propylpyridine
2-(4-methoxyphenyl)-5-propylpyridine (PubChem CID 54073906) has the molecular formula C15H17NO
and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-propylpyridine.
Molecular Properties
| Compound Name | 2-(4-methoxyphenyl)-5-propylpyridine |
| PubChem CID | 54073906 |
| Molecular Formula | C15H17NO |
| Molecular Weight | 227.31 g/mol |
| Exact Mass | 227.13 |
| IUPAC Name | 2-(4-methoxyphenyl)-5-propylpyridine |
| SMILES | CCCc1ccc(-c2ccc(OC)cc2)nc1 |
| InChI | InChI=1S/C15H17NO/c1-3-4-12-5-10-15(16-11-12)13-6-8-14(17-2)9-7-13/h5-11H,3-4H2,1-2H3 |
| InChIKey | MIJJYYRYNSAGCM-UHFFFAOYSA-N |
| XLogP | 3.71 |
| TPSA | 22.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 227.31 |
| LogP ≤ 5 | 3.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Analyze 2-(4-methoxyphenyl)-5-propylpyridine 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-(4-methoxyphenyl)-5-propylpyridine?
The IUPAC name of 2-(4-methoxyphenyl)-5-propylpyridine (CID 54073906) is 2-(4-methoxyphenyl)-5-propylpyridine.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-propylpyridine?
The canonical SMILES for 2-(4-methoxyphenyl)-5-propylpyridine is CCCc1ccc(-c2ccc(OC)cc2)nc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-propylpyridine?
The InChIKey is MIJJYYRYNSAGCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-3-4-12-5-10-15(16-11-12)13-6-8-14(17-2)9-7-13/h5-11H,3-4H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-5-propylpyridine?
2-(4-methoxyphenyl)-5-propylpyridine has a molecular weight of 227.31 g/mol, XLogP of 3.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-propylpyridine is sourced from PubChem (CID 54073906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).