4-methoxy-2-(4-propoxyphenyl)quinoline

C19H19NO2 — CID 53466443

IUPAC4-methoxy-2-(4-propoxyphenyl)quinoline
SMILESCCCOc1ccc(-c2cc(OC)c3ccccc3n2)cc1
InChIInChI=1S/C19H19NO2/c1-3-12-22-15-10-8-14(9-11-15)18-13-19(21-2)16-6-4-5-7-17(16)20-18/h4-11,13H,3,12H2,1-2H3
InChIKeyZNEMOMJMGFIEHH-UHFFFAOYSA-N
MW293.37 g/mol
LogP4.70
Rot. Bonds5

About 4-methoxy-2-(4-propoxyphenyl)quinoline

4-methoxy-2-(4-propoxyphenyl)quinoline (PubChem CID 53466443) has the molecular formula C19H19NO2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 4-methoxy-2-(4-propoxyphenyl)quinoline.

Molecular Properties

Compound Name4-methoxy-2-(4-propoxyphenyl)quinoline
PubChem CID53466443
Molecular FormulaC19H19NO2
Molecular Weight293.37 g/mol
Exact Mass293.14
IUPAC Name4-methoxy-2-(4-propoxyphenyl)quinoline
SMILESCCCOc1ccc(-c2cc(OC)c3ccccc3n2)cc1
InChIInChI=1S/C19H19NO2/c1-3-12-22-15-10-8-14(9-11-15)18-13-19(21-2)16-6-4-5-7-17(16)20-18/h4-11,13H,3,12H2,1-2H3
InChIKeyZNEMOMJMGFIEHH-UHFFFAOYSA-N
XLogP4.70
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 ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(4-propoxyphenyl)quinoline?
The IUPAC name of 4-methoxy-2-(4-propoxyphenyl)quinoline (CID 53466443) is 4-methoxy-2-(4-propoxyphenyl)quinoline.
What is the SMILES notation for 4-methoxy-2-(4-propoxyphenyl)quinoline?
The canonical SMILES for 4-methoxy-2-(4-propoxyphenyl)quinoline is CCCOc1ccc(-c2cc(OC)c3ccccc3n2)cc1.
What is the InChIKey of 4-methoxy-2-(4-propoxyphenyl)quinoline?
The InChIKey is ZNEMOMJMGFIEHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO2/c1-3-12-22-15-10-8-14(9-11-15)18-13-19(21-2)16-6-4-5-7-17(16)20-18/h4-11,13H,3,12H2,1-2H3.
What are the key properties of 4-methoxy-2-(4-propoxyphenyl)quinoline?
4-methoxy-2-(4-propoxyphenyl)quinoline has a molecular weight of 293.37 g/mol, XLogP of 4.70, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(4-propoxyphenyl)quinoline is sourced from PubChem (CID 53466443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).