Acetylleucine

Synopsis, Chemistry

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Also known as: N-acetyl-dl-leucine, 99-15-0, Ac-dl-leu-oh, 2-acetamido-4-methylpentanoic acid, Tanganil, N-acetyl-d,l-leucine

Molecular Formula

C₈H₁₅NO₃

Molecular Weight

173.21 g/mol

InChI Key

WXNXCEHXYPACJF-UHFFFAOYSA-N

FDA UNII

K76S41V71X

Used for treating vestibular-related imbalance and vertigo.

1 2D Structure

Acetylleucine

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-acetamido-4-methylpentanoic acid

2.1.2 InChI

InChI=1S/C8H15NO3/c1-5(2)4-7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)

2.1.3 InChI Key

WXNXCEHXYPACJF-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC(C)CC(C(=O)O)NC(=O)C

2.2 Other Identifiers

2.2.1 UNII

K76S41V71X

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Acetyl-dl-leucine

2. Acetylleucine, L-

3. Lasdol

4. N-acetyl-l-leucine

5. N-acetylleucine

6. Tanganil

2.3.2 Depositor-Supplied Synonyms

1. N-acetyl-dl-leucine

2. 99-15-0

3. Ac-dl-leu-oh

4. 2-acetamido-4-methylpentanoic Acid

5. Tanganil

6. N-acetyl-d,l-leucine

7. Acetyl-dl-leucine

8. Acetylleucine [inn]

9. (r,s)-n-acetylleucin

10. Acetylleucine, Dl-

11. L-leucine, N-acetyl-

12. Dl-leucine, N-acetyl-

13. Nsc-122020

14. 2-(acetylamino)-4-methylpentanoic Acid

15. K76s41v71x

16. Acetylleucine (inn)

17. Nsc-758152

18. Acetyl-d-leucine

19. Acetileucina

20. Acetylleucinum

21. Acetileucina [spanish]

22. Acetylleucinum [latin]

23. Sr-01000391875

24. Unii-k76s41v71x

25. Mfcd00065131

26. Mfcd00066069

27. Nsc-206316

28. Acetyl Dl-leucine

29. N-acetylleucine #

30. Tanganil (tn)

31. Einecs 202-734-9

32. Mfcd00026498

33. Rp 7452

34. N-acetyl-d-leucine??

35. Acetylleucine [mi]

36. N-acetyl-2-isobutylglycine

37. Leucine, N-acetyl-, Dl-

38. Oprea1_806534

39. Mls002207045

40. Acetylleucine [mart.]

41. Schembl282371

42. Acetylleucine [who-dd]

43. Acetylleucine (isomer Of 164)

44. Chembl1875805

45. Dtxsid40859594

46. Chebi:166830

47. Hms1607l21

48. Hy-b1442

49. Bbl012196

50. Nsc122020

51. Nsc203436

52. Nsc206311

53. Nsc206316

54. Stk803086

55. Akos000132161

56. Akos016039425

57. Cs-4647

58. Db13226

59. Fd20065

60. Nsc 122020

61. Nsc 758152

62. Nsc-203436

63. Nsc-206311

64. Ac-24095

65. As-14331

66. Smr001306703

67. Sy008073

68. Sy013106

69. Sy062212

70. Db-041428

71. Db-044961

72. Db-057761

73. A0097

74. Am20120403

75. Eu-0067605

76. Ft-0602607

77. Ft-0624387

78. Ft-0629837

79. D07350

80. M03064

81. Q-100915

82. Q2823840

83. Sr-01000391875-1

84. Sr-01000391875-2

85. Sr-01000391875-3

86. F0777-0821

2.4 Create Date

2005-03-25

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₅NO₃
Molecular Weight	173.21 g/mol
XLogP3	0.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	173.10519334 g/mol
Monoisotopic Mass	173.10519334 g/mol
Topological Polar Surface Area	66.4 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	177
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1