4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine

C16H19ClN2O — CID 133299117

IUPAC4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine
SMILESCCC1CN(c2ccnc3cc(Cl)ccc23)CC(C)O1
InChIInChI=1S/C16H19ClN2O/c1-3-13-10-19(9-11(2)20-13)16-6-7-18-15-8-12(17)4-5-14(15)16/h4-8,11,13H,3,9-10H2,1-2H3
InChIKeyRLWSYCJJHHMVSC-UHFFFAOYSA-N
MW290.79 g/mol
LogP3.89
Rot. Bonds2

About 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine

4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine (PubChem CID 133299117) has the molecular formula C16H19ClN2O and a molecular weight of 290.79 g/mol. Its IUPAC name is 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine.

Molecular Properties

Compound Name4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine
PubChem CID133299117
Molecular FormulaC16H19ClN2O
Molecular Weight290.79 g/mol
Exact Mass290.12
IUPAC Name4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine
SMILESCCC1CN(c2ccnc3cc(Cl)ccc23)CC(C)O1
InChIInChI=1S/C16H19ClN2O/c1-3-13-10-19(9-11(2)20-13)16-6-7-18-15-8-12(17)4-5-14(15)16/h4-8,11,13H,3,9-10H2,1-2H3
InChIKeyRLWSYCJJHHMVSC-UHFFFAOYSA-N
XLogP3.89
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.79
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(7-chloroquinolin-4-yl)-6-methylmorpholin-2-yl]methanamine
CID 102938625
1-(7-chloroquinolin-4-yl)azetidin-3-amine
CID 63759432
1-(7-chloroquinolin-4-yl)pyrrolidine-3,4-diol
CID 106673359
[4-(7-chloroquinolin-4-yl)morpholin-2-yl]methanol
CID 79839533
7-chloro-4-(3-methylpiperazin-1-yl)quinoline
CID 21101961
2-ethyl-4-(4-methoxyquinolin-6-yl)-6-methylmorpholine
CID 170227184
4-(3-bromopyrrolidin-1-yl)-7-chloroquinoline
CID 80669691
7-chloro-4-(4-pentan-3-ylpiperazin-1-yl)quinoline;hydrochloride
CID 68858916
[4-(5-chloro-2-methylphenyl)-6-methylmorpholin-2-yl]methanamine
CID 82299005
7-chloro-4-[4-[3-[4-[3-[4-[3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propyl]piperazin-1-yl]propyl]piperazin-1-yl]propyl]piperazin-1-yl]quinoline
CID 11840452
1-(7-chloroquinolin-4-yl)azepan-3-amine
CID 70760365
(3S,4S)-1-(7-chloroquinolin-4-yl)-3-(hydroxymethyl)piperidin-4-ol
CID 155498947

Frequently Asked Questions

What is the IUPAC name of 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine?
The IUPAC name of 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine (CID 133299117) is 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine.
What is the SMILES notation for 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine?
The canonical SMILES for 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine is CCC1CN(c2ccnc3cc(Cl)ccc23)CC(C)O1.
What is the InChIKey of 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine?
The InChIKey is RLWSYCJJHHMVSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O/c1-3-13-10-19(9-11(2)20-13)16-6-7-18-15-8-12(17)4-5-14(15)16/h4-8,11,13H,3,9-10H2,1-2H3.
What are the key properties of 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine?
4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine has a molecular weight of 290.79 g/mol, XLogP of 3.89, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-chloroquinolin-4-yl)-2-ethyl-6-methylmorpholine is sourced from PubChem (CID 133299117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).