4-ethoxy-2-phenylquinoline

C17H15NO — CID 14954061

IUPAC4-ethoxy-2-phenylquinoline
SMILESCCOc1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C17H15NO/c1-2-19-17-12-16(13-8-4-3-5-9-13)18-15-11-7-6-10-14(15)17/h3-12H,2H2,1H3
InChIKeyHUWDUVNMZCVTNR-UHFFFAOYSA-N
MW249.31 g/mol
LogP4.30
Rot. Bonds3

About 4-ethoxy-2-phenylquinoline

4-ethoxy-2-phenylquinoline (PubChem CID 14954061) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is 4-ethoxy-2-phenylquinoline.

Molecular Properties

Compound Name4-ethoxy-2-phenylquinoline
PubChem CID14954061
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name4-ethoxy-2-phenylquinoline
SMILESCCOc1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C17H15NO/c1-2-19-17-12-16(13-8-4-3-5-9-13)18-15-11-7-6-10-14(15)17/h3-12H,2H2,1H3
InChIKeyHUWDUVNMZCVTNR-UHFFFAOYSA-N
XLogP4.30
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-2-phenylquinoline?
The IUPAC name of 4-ethoxy-2-phenylquinoline (CID 14954061) is 4-ethoxy-2-phenylquinoline.
What is the SMILES notation for 4-ethoxy-2-phenylquinoline?
The canonical SMILES for 4-ethoxy-2-phenylquinoline is CCOc1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of 4-ethoxy-2-phenylquinoline?
The InChIKey is HUWDUVNMZCVTNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c1-2-19-17-12-16(13-8-4-3-5-9-13)18-15-11-7-6-10-14(15)17/h3-12H,2H2,1H3.
What are the key properties of 4-ethoxy-2-phenylquinoline?
4-ethoxy-2-phenylquinoline has a molecular weight of 249.31 g/mol, XLogP of 4.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-2-phenylquinoline is sourced from PubChem (CID 14954061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).