7-ethoxy-4-methyl-6-phenylmethoxyquinoline

C19H19NO2 — CID 146508381

IUPAC7-ethoxy-4-methyl-6-phenylmethoxyquinoline
SMILESCCOc1cc2nccc(C)c2cc1OCc1ccccc1
InChIInChI=1S/C19H19NO2/c1-3-21-19-12-17-16(14(2)9-10-20-17)11-18(19)22-13-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3
InChIKeyGAIGFPDLRLVPJX-UHFFFAOYSA-N
MW293.37 g/mol
LogP4.52
Rot. Bonds5

About 7-ethoxy-4-methyl-6-phenylmethoxyquinoline

7-ethoxy-4-methyl-6-phenylmethoxyquinoline (PubChem CID 146508381) has the molecular formula C19H19NO2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 7-ethoxy-4-methyl-6-phenylmethoxyquinoline.

Molecular Properties

Compound Name7-ethoxy-4-methyl-6-phenylmethoxyquinoline
PubChem CID146508381
Molecular FormulaC19H19NO2
Molecular Weight293.37 g/mol
Exact Mass293.14
IUPAC Name7-ethoxy-4-methyl-6-phenylmethoxyquinoline
SMILESCCOc1cc2nccc(C)c2cc1OCc1ccccc1
InChIInChI=1S/C19H19NO2/c1-3-21-19-12-17-16(14(2)9-10-20-17)11-18(19)22-13-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3
InChIKeyGAIGFPDLRLVPJX-UHFFFAOYSA-N
XLogP4.52
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-ethoxy-4-methyl-6-phenylmethoxyquinoline?
The IUPAC name of 7-ethoxy-4-methyl-6-phenylmethoxyquinoline (CID 146508381) is 7-ethoxy-4-methyl-6-phenylmethoxyquinoline.
What is the SMILES notation for 7-ethoxy-4-methyl-6-phenylmethoxyquinoline?
The canonical SMILES for 7-ethoxy-4-methyl-6-phenylmethoxyquinoline is CCOc1cc2nccc(C)c2cc1OCc1ccccc1.
What is the InChIKey of 7-ethoxy-4-methyl-6-phenylmethoxyquinoline?
The InChIKey is GAIGFPDLRLVPJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO2/c1-3-21-19-12-17-16(14(2)9-10-20-17)11-18(19)22-13-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3.
What are the key properties of 7-ethoxy-4-methyl-6-phenylmethoxyquinoline?
7-ethoxy-4-methyl-6-phenylmethoxyquinoline has a molecular weight of 293.37 g/mol, XLogP of 4.52, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethoxy-4-methyl-6-phenylmethoxyquinoline is sourced from PubChem (CID 146508381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).