(4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone

C16H17ClN2O2 — CID 63375773

IUPAC(4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone
SMILESCCC1CN(C(=O)c2cc(Cl)c3ccccc3n2)CCO1
InChIInChI=1S/C16H17ClN2O2/c1-2-11-10-19(7-8-21-11)16(20)15-9-13(17)12-5-3-4-6-14(12)18-15/h3-6,9,11H,2,7-8,10H2,1H3
InChIKeyKCQFKMJMGOWXFO-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.14
Rot. Bonds2

About (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone

(4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone (PubChem CID 63375773) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone
PubChem CID63375773
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC Name(4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone
SMILESCCC1CN(C(=O)c2cc(Cl)c3ccccc3n2)CCO1
InChIInChI=1S/C16H17ClN2O2/c1-2-11-10-19(7-8-21-11)16(20)15-9-13(17)12-5-3-4-6-14(12)18-15/h3-6,9,11H,2,7-8,10H2,1H3
InChIKeyKCQFKMJMGOWXFO-UHFFFAOYSA-N
XLogP3.14
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-chloroquinolin-2-yl)-(3-methylazetidin-1-yl)methanone
CID 167993187
(4-chloroquinolin-2-yl)-(3,5-dimethylpiperidin-1-yl)methanone
CID 63376375
(4-chloroquinolin-2-yl)-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 102957022
(4-chloroquinolin-2-yl)-[(3R)-3-(hydroxymethyl)piperidin-1-yl]methanone
CID 99036740
(6-chloropyridazin-3-yl)-(2-ethylmorpholin-4-yl)methanone
CID 60857887
(6-amino-3-chloro-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone
CID 62155508
(4-chloroquinolin-2-yl)-(3,6-dihydro-2H-pyridin-1-yl)methanone
CID 114408574
(2-ethylmorpholin-4-yl)-(6-methoxyquinolin-2-yl)methanone
CID 146085525
(4-chloroquinolin-2-yl)-(4-hydroxy-4-methylpiperidin-1-yl)methanone
CID 81096876
3-(2-ethylmorpholine-4-carbonyl)benzoic acid
CID 43563067
(5-amino-2-chlorophenyl)-(2-ethylmorpholin-4-yl)methanone
CID 43562207
(5-chloro-2-fluorophenyl)-(2-ethylmorpholin-4-yl)methanone
CID 60733638

Frequently Asked Questions

What is the IUPAC name of (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone?
The IUPAC name of (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone (CID 63375773) is (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone.
What is the SMILES notation for (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone?
The canonical SMILES for (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone is CCC1CN(C(=O)c2cc(Cl)c3ccccc3n2)CCO1.
What is the InChIKey of (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone?
The InChIKey is KCQFKMJMGOWXFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-2-11-10-19(7-8-21-11)16(20)15-9-13(17)12-5-3-4-6-14(12)18-15/h3-6,9,11H,2,7-8,10H2,1H3.
What are the key properties of (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone?
(4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone has a molecular weight of 304.78 g/mol, XLogP of 3.14, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloroquinolin-2-yl)-(2-ethylmorpholin-4-yl)methanone is sourced from PubChem (CID 63375773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).