6-ethenyl-3-(2-methoxyethoxy)quinoline

C14H15NO2 — CID 58270232

IUPAC6-ethenyl-3-(2-methoxyethoxy)quinoline
SMILESC=Cc1ccc2ncc(OCCOC)cc2c1
InChIInChI=1S/C14H15NO2/c1-3-11-4-5-14-12(8-11)9-13(10-15-14)17-7-6-16-2/h3-5,8-10H,1,6-7H2,2H3
InChIKeyOQXNZZRDNAUANK-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.90
Rot. Bonds5

About 6-ethenyl-3-(2-methoxyethoxy)quinoline

6-ethenyl-3-(2-methoxyethoxy)quinoline (PubChem CID 58270232) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 6-ethenyl-3-(2-methoxyethoxy)quinoline.

Molecular Properties

Compound Name6-ethenyl-3-(2-methoxyethoxy)quinoline
PubChem CID58270232
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name6-ethenyl-3-(2-methoxyethoxy)quinoline
SMILESC=Cc1ccc2ncc(OCCOC)cc2c1
InChIInChI=1S/C14H15NO2/c1-3-11-4-5-14-12(8-11)9-13(10-15-14)17-7-6-16-2/h3-5,8-10H,1,6-7H2,2H3
InChIKeyOQXNZZRDNAUANK-UHFFFAOYSA-N
XLogP2.90
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-3-(2-methoxyethoxy)quinoline?
The IUPAC name of 6-ethenyl-3-(2-methoxyethoxy)quinoline (CID 58270232) is 6-ethenyl-3-(2-methoxyethoxy)quinoline.
What is the SMILES notation for 6-ethenyl-3-(2-methoxyethoxy)quinoline?
The canonical SMILES for 6-ethenyl-3-(2-methoxyethoxy)quinoline is C=Cc1ccc2ncc(OCCOC)cc2c1.
What is the InChIKey of 6-ethenyl-3-(2-methoxyethoxy)quinoline?
The InChIKey is OQXNZZRDNAUANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-3-11-4-5-14-12(8-11)9-13(10-15-14)17-7-6-16-2/h3-5,8-10H,1,6-7H2,2H3.
What are the key properties of 6-ethenyl-3-(2-methoxyethoxy)quinoline?
6-ethenyl-3-(2-methoxyethoxy)quinoline has a molecular weight of 229.28 g/mol, XLogP of 2.90, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-3-(2-methoxyethoxy)quinoline is sourced from PubChem (CID 58270232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).