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2D Structure
Also known as: 669770-29-0, Aqw051, Jqh481r778, (3r)-3-{[6-(4-methylphenyl)pyridin-3-yl]oxy}-1-azabicyclo[2.2.2]octane, (3r)-3-((6-(4-methylphenyl)pyridin-3-yl)oxy)-1-azabicyclo(2.2.2)octane, Refchem:113617
Molecular Formula
C19H22N2O
Molecular Weight
294.4  g/mol
InChI Key
NPDLTEZXGWRMLQ-IBGZPJMESA-N
FDA UNII
JQH481R778

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(3R)-3-[[6-(4-methylphenyl)-3-pyridinyl]oxy]-1-azabicyclo[2.2.2]octane
2.1.2 InChI
InChI=1S/C19H22N2O/c1-14-2-4-15(5-3-14)18-7-6-17(12-20-18)22-19-13-21-10-8-16(19)9-11-21/h2-7,12,16,19H,8-11,13H2,1H3/t19-/m0/s1
2.1.3 InChI Key
NPDLTEZXGWRMLQ-IBGZPJMESA-N
2.2 Other Identifiers
2.2.1 UNII
JQH481R778
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Aqw051

2.3.2 Depositor-Supplied Synonyms

1. 669770-29-0

2. Aqw051

3. Jqh481r778

4. (3r)-3-{[6-(4-methylphenyl)pyridin-3-yl]oxy}-1-azabicyclo[2.2.2]octane

5. (3r)-3-((6-(4-methylphenyl)pyridin-3-yl)oxy)-1-azabicyclo(2.2.2)octane

6. Refchem:113617

7. Vqw-765

8. 1-azabicyclo[2.2.2]octane, 3-[[6-(4-methylphenyl)-3-pyridinyl]oxy]-, (3r)-

9. Mfcd28502153

10. Chembl4532388

11. (r)-3-((6-(p-tolyl)pyridin-3-yl)oxy)quinuclidine

12. (3r)-3-[6-(4-methylphenyl)pyridin-3-yl]oxy-1-azabicyclo[2.2.2]octane

13. 1-azabicyclo(2.2.2)octane, 3-((6-(4-methylphenyl)-3-pyridinyl)oxy)-, (3r)-

14. Aqw 051

15. Npdltezxgwrmlq-ibgzpjmesa-n

16. Nvp-aqw051

17. Unii-jqh481r778

18. Gtpl7371

19. Orb1701184

20. Schembl1459285

21. Vqw765

22. Vqw 765

23. Glxc-15846

24. Bdbm50520725

25. Akos030628482

26. As-35273

27. Da-50661

28. Hy-19490

29. Cs-0015589

30. (3r)-3-[[6-(p-tolyl)-3-pyridyl]oxy]quinuclidine

31. Q27074487

32. (r)-3-(6-p-tolyl-pyridin-3-yloxy)-1-aza-bicyclo[2.2.2]octane

2.4 Create Date
2011-03-14
3 Chemical and Physical Properties
Molecular Weight 294.4 g/mol
Molecular Formula C19H22N2O
XLogP33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area25.4
Heavy Atom Count22
Formal Charge0
Complexity358
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1