About 8-(4-ethenyl-3-ethylphenyl)quinoline
8-(4-ethenyl-3-ethylphenyl)quinoline (PubChem CID 129042695) has the molecular formula C19H17N
and a molecular weight of 259.35 g/mol. Its IUPAC name is 8-(4-ethenyl-3-ethylphenyl)quinoline.
Molecular Properties
| Compound Name | 8-(4-ethenyl-3-ethylphenyl)quinoline |
| PubChem CID | 129042695 |
| Molecular Formula | C19H17N |
| Molecular Weight | 259.35 g/mol |
| Exact Mass | 259.14 |
| IUPAC Name | 8-(4-ethenyl-3-ethylphenyl)quinoline |
| SMILES | C=Cc1ccc(-c2cccc3cccnc23)cc1CC |
| InChI | InChI=1S/C19H17N/c1-3-14-10-11-17(13-15(14)4-2)18-9-5-7-16-8-6-12-20-19(16)18/h3,5-13H,1,4H2,2H3 |
| InChIKey | HCCHSYDLTZGVAP-UHFFFAOYSA-N |
| XLogP | 5.11 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 259.35 |
| LogP ≤ 5 | 5.11 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 8-(4-ethenyl-3-ethylphenyl)quinoline?
The IUPAC name of 8-(4-ethenyl-3-ethylphenyl)quinoline (CID 129042695) is 8-(4-ethenyl-3-ethylphenyl)quinoline.
What is the SMILES notation for 8-(4-ethenyl-3-ethylphenyl)quinoline?
The canonical SMILES for 8-(4-ethenyl-3-ethylphenyl)quinoline is C=Cc1ccc(-c2cccc3cccnc23)cc1CC.
What is the InChIKey of 8-(4-ethenyl-3-ethylphenyl)quinoline?
The InChIKey is HCCHSYDLTZGVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N/c1-3-14-10-11-17(13-15(14)4-2)18-9-5-7-16-8-6-12-20-19(16)18/h3,5-13H,1,4H2,2H3.
What are the key properties of 8-(4-ethenyl-3-ethylphenyl)quinoline?
8-(4-ethenyl-3-ethylphenyl)quinoline has a molecular weight of 259.35 g/mol, XLogP of 5.11, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-ethenyl-3-ethylphenyl)quinoline is sourced from PubChem (CID 129042695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).