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CHEMISTRY
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Also known as: Mk-8998, 953778-58-0, (r)-2-(4-isopropylphenyl)-n-(1-(5-(2,2,2-trifluoroethoxy)pyridin-2-yl)ethyl)acetamide, Jzp385, Cx-8998, Suvecaltamide [usan]

Molecular Formula

C₂₀H₂₃F₃N₂O₂

Molecular Weight

380.4 g/mol

InChI Key

IQIKXZMPPBEWAD-CQSZACIVSA-N

FDA UNII

MIA4WMP8QN

1 2D Structure

Suvecaltamide

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(4-propan-2-ylphenyl)-N-[(1R)-1-[5-(2,2,2-trifluoroethoxy)pyridin-2-yl]ethyl]acetamide

2.1.2 InChI

InChI=1S/C20H23F3N2O2/c1-13(2)16-6-4-15(5-7-16)10-19(26)25-14(3)18-9-8-17(11-24-18)27-12-20(21,22)23/h4-9,11,13-14H,10,12H2,1-3H3,(H,25,26)/t14-/m1/s1

2.1.3 InChI Key

IQIKXZMPPBEWAD-CQSZACIVSA-N

2.1.4 Canonical SMILES

CC(C)C1=CC=C(C=C1)CC(=O)NC(C)C2=NC=C(C=C2)OCC(F)(F)F

2.1.5 Isomeric SMILES

C[C@H](C1=NC=C(C=C1)OCC(F)(F)F)NC(=O)CC2=CC=C(C=C2)C(C)C

2.2 Other Identifiers

2.2.1 UNII

MIA4WMP8QN

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. Mk-8998

2. 953778-58-0

3. (r)-2-(4-isopropylphenyl)-n-(1-(5-(2,2,2-trifluoroethoxy)pyridin-2-yl)ethyl)acetamide

4. Jzp385

5. Cx-8998

6. Suvecaltamide [usan]

7. Jzp-385

8. Mia4wmp8qn

9. Chembl1684950

10. Mk8998

11. 2-(4-propan-2-ylphenyl)-n-[(1r)-1-[5-(2,2,2-trifluoroethoxy)pyridin-2-yl]ethyl]acetamide

12. Benzeneacetamide, 4-(1-methylethyl)-n-((1r)-1-(5-(2,2,2-trifluoroethoxy)-2-pyridinyl)ethyl)-

13. Mk-8998 Free Base

14. 2-(4-isopropylphenyl)-n-[(1r)-1-(5-(2,2,2-trifluoroethoxy)pyridin-2-yl)ethyl]acetamide

15. 2-(4-isopropylphenyl)-n-[(1r)-1-[5-(2,2,2-trifluoroethoxy)pyridin-2-yl]ethyl]acetamide

16. Unii-mia4wmp8qn

17. Suvecaltamide [inn]

18. Suvecaltamide [who-dd]

19. Schembl1065999

20. Gtpl12648

21. Glxc-10813

22. Bcp18693

23. Ex-a2479

24. Bdbm50192668

25. Who 11291

26. Akos032945005

27. Compound 1 [pmid: 27579577]

28. Compound 1 [pmid: 34582192]

29. Cs-6198

30. Ac-35480

31. Bs-17962

32. Cid 24765479

33. Mk-8998?

34. Db-362320

35. Hy-101096

36. C77290

37. A922518

38. 4-(1-methylethyl)-n-((1r)-1-(5-(2,2,2-trifluoroethoxy)-2-pyridinyl)ethyl)benzeneacetamide

2.4 Create Date

2008-04-21

3 Chemical and Physical Properties

Molecular Formula	C₂₀H₂₃F₃N₂O₂
Molecular Weight	380.4 g/mol
XLogP3	4.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	7
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	51.2
Heavy Atom Count	27
Formal Charge	0
Complexity	463
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1