2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline

C24H22N2O2 — CID 71734111

IUPAC2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline
SMILESCCCOc1ccc(-c2cc(OCc3ccccn3)c3ccccc3n2)cc1
InChIInChI=1S/C24H22N2O2/c1-2-15-27-20-12-10-18(11-13-20)23-16-24(21-8-3-4-9-22(21)26-23)28-17-19-7-5-6-14-25-19/h3-14,16H,2,15,17H2,1H3
InChIKeyKBMRULWZARHJHH-UHFFFAOYSA-N
MW370.45 g/mol
LogP5.66
Rot. Bonds7

About 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline

2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline (PubChem CID 71734111) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline.

Molecular Properties

Compound Name2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline
PubChem CID71734111
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC Name2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline
SMILESCCCOc1ccc(-c2cc(OCc3ccccn3)c3ccccc3n2)cc1
InChIInChI=1S/C24H22N2O2/c1-2-15-27-20-12-10-18(11-13-20)23-16-24(21-8-3-4-9-22(21)26-23)28-17-19-7-5-6-14-25-19/h3-14,16H,2,15,17H2,1H3
InChIKeyKBMRULWZARHJHH-UHFFFAOYSA-N
XLogP5.66
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.45
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline?
The IUPAC name of 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline (CID 71734111) is 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline.
What is the SMILES notation for 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline?
The canonical SMILES for 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline is CCCOc1ccc(-c2cc(OCc3ccccn3)c3ccccc3n2)cc1.
What is the InChIKey of 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline?
The InChIKey is KBMRULWZARHJHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-2-15-27-20-12-10-18(11-13-20)23-16-24(21-8-3-4-9-22(21)26-23)28-17-19-7-5-6-14-25-19/h3-14,16H,2,15,17H2,1H3.
What are the key properties of 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline?
2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline has a molecular weight of 370.45 g/mol, XLogP of 5.66, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propoxyphenyl)-4-(pyridin-2-ylmethoxy)quinoline is sourced from PubChem (CID 71734111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).