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ACTIVE PHARMA INGREDIENTS

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Chemistry

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Also known as: 7531-52-4, Prolinamide, H-pro-nh2, (s)-pyrrolidine-2-carboxamide, (s)-prolinamide, (2s)-pyrrolidine-2-carboxamide

Molecular Formula

C₅H₁₀N₂O

Molecular Weight

114.15 g/mol

InChI Key

VLJNHYLEOZPXFW-BYPYZUCNSA-N

FDA UNII

VD6PQK9DHG

1 2D Structure

L Prolinamide

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(2S)-pyrrolidine-2-carboxamide

2.1.2 InChI

InChI=1S/C5H10N2O/c6-5(8)4-2-1-3-7-4/h4,7H,1-3H2,(H2,6,8)/t4-/m0/s1

2.1.3 InChI Key

VLJNHYLEOZPXFW-BYPYZUCNSA-N

2.1.4 Canonical SMILES

C1CC(NC1)C(=O)N

2.1.5 Isomeric SMILES

C1C[C@H](NC1)C(=O)N

2.2 Other Identifiers

2.2.1 UNII

VD6PQK9DHG

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 2-pyrrolidinecarboxamide

2. Prolinamide

3. Prolinamide, (l)-isomer

2.3.2 Depositor-Supplied Synonyms

1. 7531-52-4

2. Prolinamide

3. H-pro-nh2

4. (s)-pyrrolidine-2-carboxamide

5. (s)-prolinamide

6. (2s)-pyrrolidine-2-carboxamide

7. L-proline Amide

8. L-prolineamide

9. (s)-2-pyrrolidinecarboxamide

10. 58274-20-7

11. Proline Amide

12. (s)-proline Amide

13. 2-pyrrolidinecarboxamide,(s)-

14. L-(-)-prolinamide

15. Vd6pqk9dhg

16. (2s)-2-pyrrolidinecarboxamide

17. Chebi:21374

18. Mfcd00005253

19. (s)-pyrrolidine-2-carboxylic Acid Amide

20. 2-pyrrolidinecarboxamide, (2s)-

21. Unii-vd6pqk9dhg

22. (2s)-2-carbamoylpyrrolidine

23. Proline Imide

24. (2s)pyrrolidine-2-carboxamide

25. L-proline Amid

26. (2s)-prolinamide

27. Lpd

28. Einecs 231-397-0

29. Pronh2

30. L-(-) Prolinamide

31. H-pronh2

32. L-pronh2

33. L-prolinamide, 98%

34. Prolinamide, L-

35. 2-pyrrolidinecarboxamide #

36. Ec 231-397-0

37. H-l-pro-nh2

38. Schembl240170

39. (s)-prrolidine-2-carboxamide

40. (s)-2-pyrrolidine Carboxamide

41. Chembl1222059

42. 2-pyrrolidinecarboxamide, (s)-

43. Dtxsid00226268

44. Zinc391898

45. Act05030

46. Albb-014823

47. Cs-d1209

48. Akos005174571

49. Akos015854494

50. Ncgc00159402-02

51. Ac-24602

52. Ac-25877

53. Bp-10428

54. Hy-20582

55. Ts-01579

56. Db-029980

57. Am20100732

58. P1382

59. A26952

60. C19781

61. S)-pyrrolidine-2-carboxylic Acid Amide

62. (2s)-pyrrolidine-2-carboxamide (l-prolinamide)

63. 429p276

64. A839595

65. J-524162

66. Q-102892

67. Q27103084

68. F1905-7145

69. (s)-pyrrolidine-2-carboxylic Acid Amide;(s)-prolinamide; L-proline Amide;l-(-)-prolinamide

2.4 Create Date

2005-06-23

3 Chemical and Physical Properties

Molecular Formula	C₅H₁₀N₂O
Molecular Weight	114.15 g/mol
XLogP3	-0.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	114.079312947 g/mol
Monoisotopic Mass	114.079312947 g/mol
Topological Polar Surface Area	55.1 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	103
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