8-(4-ethenyl-3-ethylphenyl)quinoline

C19H17N — CID 129042695

IUPAC8-(4-ethenyl-3-ethylphenyl)quinoline
SMILESC=Cc1ccc(-c2cccc3cccnc23)cc1CC
InChIInChI=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
InChIKeyHCCHSYDLTZGVAP-UHFFFAOYSA-N
MW259.35 g/mol
LogP5.11
Rot. Bonds3

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 Name8-(4-ethenyl-3-ethylphenyl)quinoline
PubChem CID129042695
Molecular FormulaC19H17N
Molecular Weight259.35 g/mol
Exact Mass259.14
IUPAC Name8-(4-ethenyl-3-ethylphenyl)quinoline
SMILESC=Cc1ccc(-c2cccc3cccnc23)cc1CC
InChIInChI=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
InChIKeyHCCHSYDLTZGVAP-UHFFFAOYSA-N
XLogP5.11
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.35
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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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).