2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline

C21H20N2O — CID 173427428

IUPAC2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline
SMILESCCc1ccc2c(c1)c(OC)cc1nc(Cc3ccccc3)cn12
InChIInChI=1S/C21H20N2O/c1-3-15-9-10-19-18(12-15)20(24-2)13-21-22-17(14-23(19)21)11-16-7-5-4-6-8-16/h4-10,12-14H,3,11H2,1-2H3
InChIKeyYDCFMOVMKBPZTG-UHFFFAOYSA-N
MW316.40 g/mol
LogP4.65
Rot. Bonds4

About 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline

2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline (PubChem CID 173427428) has the molecular formula C21H20N2O and a molecular weight of 316.40 g/mol. Its IUPAC name is 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline.

Molecular Properties

Compound Name2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline
PubChem CID173427428
Molecular FormulaC21H20N2O
Molecular Weight316.40 g/mol
Exact Mass316.16
IUPAC Name2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline
SMILESCCc1ccc2c(c1)c(OC)cc1nc(Cc3ccccc3)cn12
InChIInChI=1S/C21H20N2O/c1-3-15-9-10-19-18(12-15)20(24-2)13-21-22-17(14-23(19)21)11-16-7-5-4-6-8-16/h4-10,12-14H,3,11H2,1-2H3
InChIKeyYDCFMOVMKBPZTG-UHFFFAOYSA-N
XLogP4.65
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline?
The IUPAC name of 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline (CID 173427428) is 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline.
What is the SMILES notation for 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline?
The canonical SMILES for 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline is CCc1ccc2c(c1)c(OC)cc1nc(Cc3ccccc3)cn12.
What is the InChIKey of 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline?
The InChIKey is YDCFMOVMKBPZTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O/c1-3-15-9-10-19-18(12-15)20(24-2)13-21-22-17(14-23(19)21)11-16-7-5-4-6-8-16/h4-10,12-14H,3,11H2,1-2H3.
What are the key properties of 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline?
2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline has a molecular weight of 316.40 g/mol, XLogP of 4.65, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-7-ethyl-5-methoxyimidazo[1,2-a]quinoline is sourced from PubChem (CID 173427428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).