7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline

C17H22N2O — CID 71574715

IUPAC7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline
SMILESCCCCCCOc1ccc2c(c1)CCc1nccn1-2
InChIInChI=1S/C17H22N2O/c1-2-3-4-5-12-20-15-7-8-16-14(13-15)6-9-17-18-10-11-19(16)17/h7-8,10-11,13H,2-6,9,12H2,1H3
InChIKeyBAQXXFKOZYOWMB-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.93
Rot. Bonds6

About 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline

7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline (PubChem CID 71574715) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline.

Molecular Properties

Compound Name7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline
PubChem CID71574715
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline
SMILESCCCCCCOc1ccc2c(c1)CCc1nccn1-2
InChIInChI=1S/C17H22N2O/c1-2-3-4-5-12-20-15-7-8-16-14(13-15)6-9-17-18-10-11-19(16)17/h7-8,10-11,13H,2-6,9,12H2,1H3
InChIKeyBAQXXFKOZYOWMB-UHFFFAOYSA-N
XLogP3.93
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline?
The IUPAC name of 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline (CID 71574715) is 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline.
What is the SMILES notation for 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline?
The canonical SMILES for 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline is CCCCCCOc1ccc2c(c1)CCc1nccn1-2.
What is the InChIKey of 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline?
The InChIKey is BAQXXFKOZYOWMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-2-3-4-5-12-20-15-7-8-16-14(13-15)6-9-17-18-10-11-19(16)17/h7-8,10-11,13H,2-6,9,12H2,1H3.
What are the key properties of 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline?
7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline has a molecular weight of 270.38 g/mol, XLogP of 3.93, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hexoxy-4,5-dihydroimidazo[1,2-a]quinoline is sourced from PubChem (CID 71574715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).