2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine

C15H19ClN2O — CID 146013303

IUPAC2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine
SMILESCCN(CC)CCOc1ccc(Cl)c2cccnc12
InChIInChI=1S/C15H19ClN2O/c1-3-18(4-2)10-11-19-14-8-7-13(16)12-6-5-9-17-15(12)14/h5-9H,3-4,10-11H2,1-2H3
InChIKeyLLWBUUWHYXOKCL-UHFFFAOYSA-N
MW278.78 g/mol
LogP3.61
Rot. Bonds6

About 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine

2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine (PubChem CID 146013303) has the molecular formula C15H19ClN2O and a molecular weight of 278.78 g/mol. Its IUPAC name is 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine.

Molecular Properties

Compound Name2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine
PubChem CID146013303
Molecular FormulaC15H19ClN2O
Molecular Weight278.78 g/mol
Exact Mass278.12
IUPAC Name2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine
SMILESCCN(CC)CCOc1ccc(Cl)c2cccnc12
InChIInChI=1S/C15H19ClN2O/c1-3-18(4-2)10-11-19-14-8-7-13(16)12-6-5-9-17-15(12)14/h5-9H,3-4,10-11H2,1-2H3
InChIKeyLLWBUUWHYXOKCL-UHFFFAOYSA-N
XLogP3.61
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-8-(6-chlorohexoxy)quinoline
CID 55193642
5-chloro-8-(5-chloropentoxy)quinoline
CID 43348411
5-(5-chloroquinolin-8-yl)oxypentan-1-amine
CID 54965610
(5-chloroquinolin-8-yl) N,N-diethylcarbamate
CID 712597
3-[[2-(5-chloroquinolin-8-yl)oxyacetyl]-ethylamino]propanoic acid
CID 120516814
CID 12945983
CID 12945983
2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol
CID 60509838
4-[2-(5-chloroquinolin-8-yl)oxyethoxy]benzonitrile
CID 2216428
methyl 2-(5-chloroquinolin-8-yl)oxyacetate
CID 15257198
(5-chloroquinolin-8-yl) methanesulfonate
CID 86302357
O-dodecyl 2-(5-chloroquinolin-8-yl)oxyethanethioate
CID 19839509
N,N-diethyl-2-(1,7-phenanthrolin-8-yloxy)ethanamine
CID 14040332

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine?
The IUPAC name of 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine (CID 146013303) is 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine.
What is the SMILES notation for 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine?
The canonical SMILES for 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine is CCN(CC)CCOc1ccc(Cl)c2cccnc12.
What is the InChIKey of 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine?
The InChIKey is LLWBUUWHYXOKCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O/c1-3-18(4-2)10-11-19-14-8-7-13(16)12-6-5-9-17-15(12)14/h5-9H,3-4,10-11H2,1-2H3.
What are the key properties of 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine?
2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine has a molecular weight of 278.78 g/mol, XLogP of 3.61, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine is sourced from PubChem (CID 146013303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).