About 5-(5-propylpyrazol-1-yl)quinoline
5-(5-propylpyrazol-1-yl)quinoline (PubChem CID 139907305) has the molecular formula C15H15N3
and a molecular weight of 237.31 g/mol. Its IUPAC name is 5-(5-propylpyrazol-1-yl)quinoline.
Molecular Properties
| Compound Name | 5-(5-propylpyrazol-1-yl)quinoline |
| PubChem CID | 139907305 |
| Molecular Formula | C15H15N3 |
| Molecular Weight | 237.31 g/mol |
| Exact Mass | 237.13 |
| IUPAC Name | 5-(5-propylpyrazol-1-yl)quinoline |
| SMILES | CCCc1ccnn1-c1cccc2ncccc12 |
| InChI | InChI=1S/C15H15N3/c1-2-5-12-9-11-17-18(12)15-8-3-7-14-13(15)6-4-10-16-14/h3-4,6-11H,2,5H2,1H3 |
| InChIKey | POSOHGABIUJNAD-UHFFFAOYSA-N |
| XLogP | 3.37 |
| TPSA | 30.71 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 237.31 |
| LogP ≤ 5 | 3.37 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5-(5-propylpyrazol-1-yl)quinoline?
The IUPAC name of 5-(5-propylpyrazol-1-yl)quinoline (CID 139907305) is 5-(5-propylpyrazol-1-yl)quinoline.
What is the SMILES notation for 5-(5-propylpyrazol-1-yl)quinoline?
The canonical SMILES for 5-(5-propylpyrazol-1-yl)quinoline is CCCc1ccnn1-c1cccc2ncccc12.
What is the InChIKey of 5-(5-propylpyrazol-1-yl)quinoline?
The InChIKey is POSOHGABIUJNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-2-5-12-9-11-17-18(12)15-8-3-7-14-13(15)6-4-10-16-14/h3-4,6-11H,2,5H2,1H3.
What are the key properties of 5-(5-propylpyrazol-1-yl)quinoline?
5-(5-propylpyrazol-1-yl)quinoline has a molecular weight of 237.31 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-propylpyrazol-1-yl)quinoline is sourced from PubChem (CID 139907305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).