2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine

C16H21ClN2O — CID 154130691

IUPAC2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine
SMILESCCN(CC)CCOc1cc(C)c2ccc(Cl)cc2n1
InChIInChI=1S/C16H21ClN2O/c1-4-19(5-2)8-9-20-16-10-12(3)14-7-6-13(17)11-15(14)18-16/h6-7,10-11H,4-5,8-9H2,1-3H3
InChIKeyOWWWXEBPFWNPOG-UHFFFAOYSA-N
MW292.81 g/mol
LogP3.92
Rot. Bonds6

About 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine

2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine (PubChem CID 154130691) has the molecular formula C16H21ClN2O and a molecular weight of 292.81 g/mol. Its IUPAC name is 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine.

Molecular Properties

Compound Name2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine
PubChem CID154130691
Molecular FormulaC16H21ClN2O
Molecular Weight292.81 g/mol
Exact Mass292.13
IUPAC Name2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine
SMILESCCN(CC)CCOc1cc(C)c2ccc(Cl)cc2n1
InChIInChI=1S/C16H21ClN2O/c1-4-19(5-2)8-9-20-16-10-12(3)14-7-6-13(17)11-15(14)18-16/h6-7,10-11H,4-5,8-9H2,1-3H3
InChIKeyOWWWXEBPFWNPOG-UHFFFAOYSA-N
XLogP3.92
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.81
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N'-[2-(7-chloroquinolin-4-yl)oxyethyl]-N,N,N'-triethylpropane-1,3-diamine
CID 46225697
N,N-diethyl-2-(2,4,6-trimethylphenoxy)ethanamine
CID 2848079
N,N-diethyl-2-[4-(methylaminomethyl)quinolin-2-yl]oxyethanamine
CID 62296835
3-(4-chloro-2,6-dimethylphenoxy)-N,N-diethylpropan-1-amine
CID 2249602
2-[2-(4-chloro-2,6-dimethylphenoxy)ethoxy]-N,N-diethylethanamine
CID 2245338
ethane;2-ethoxy-4-methylquinoline
CID 142037221
N-(7-chloro-3-methylquinolin-4-yl)-N',N'-diethylpropane-1,3-diamine
CID 58467346
N,N-diethyl-2-(1,7-phenanthrolin-8-yloxy)ethanamine
CID 14040332
2-[2-(diethylamino)ethoxy]-N-(2,6-dimethylphenyl)quinoline-4-carboxamide
CID 28239
3-chloro-6-[2-(diethylamino)ethoxy]-10H-acridin-9-one
CID 59242964
2-[4-(4-chlorophenoxy)phenoxy]-N,N-diethylethanamine
CID 21318117
2-[2-(diethylamino)ethoxy]-7-methoxypyridazino[6,1-b]quinazolin-10-one
CID 3305931

Frequently Asked Questions

What is the IUPAC name of 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine?
The IUPAC name of 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine (CID 154130691) is 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine.
What is the SMILES notation for 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine?
The canonical SMILES for 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine is CCN(CC)CCOc1cc(C)c2ccc(Cl)cc2n1.
What is the InChIKey of 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine?
The InChIKey is OWWWXEBPFWNPOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21ClN2O/c1-4-19(5-2)8-9-20-16-10-12(3)14-7-6-13(17)11-15(14)18-16/h6-7,10-11H,4-5,8-9H2,1-3H3.
What are the key properties of 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine?
2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine has a molecular weight of 292.81 g/mol, XLogP of 3.92, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-chloro-4-methylquinolin-2-yl)oxy-N,N-diethylethanamine is sourced from PubChem (CID 154130691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).