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Also known as: Piperidine-4-carboxylic acid, 498-94-2, 4-piperidinecarboxylic acid, 4-carboxypiperidine, Hexahydroisonicotinic acid, H-inp-oh
Molecular Formula
C6H11NO2
Molecular Weight
129.16  g/mol
InChI Key
SRJOCJYGOFTFLH-UHFFFAOYSA-N
FDA UNII
M5TZP1RWIE

CAS 498-94-2
1 2D Structure

CAS 498-94-2

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
piperidine-4-carboxylic acid
2.1.2 InChI
InChI=1S/C6H11NO2/c8-6(9)5-1-3-7-4-2-5/h5,7H,1-4H2,(H,8,9)
2.1.3 InChI Key
SRJOCJYGOFTFLH-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CNCCC1C(=O)O
2.2 Other Identifiers
2.2.1 UNII
M5TZP1RWIE
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 4-piperidinecarboxylic Acid

2.3.2 Depositor-Supplied Synonyms

1. Piperidine-4-carboxylic Acid

2. 498-94-2

3. 4-piperidinecarboxylic Acid

4. 4-carboxypiperidine

5. Hexahydroisonicotinic Acid

6. H-inp-oh

7. Dl-isopipecolinic Acid

8. Isonicotinic Acid, Hexahydro-

9. Acide Isonipecotique

10. 4-hexahydroisonicotinic Acid

11. Mfcd00006004

12. Nsc 61049

13. Iso-nipecotic Acid

14. Acide Piperidine-carboxylique-4

15. H-pic(4)-oh

16. M5tzp1rwie

17. 4-piperidine Carboxylic Acid

18. Chembl279998

19. Nsc-61049

20. Acide Isonipecotique [french]

21. Unii-m5tzp1rwie

22. Einecs 207-872-3

23. Brn 0112553

24. Acide Piperidine-carboxylique-4 [french]

25. Isonipecolinic Acid

26. Isonipecotinic Acid

27. 4-carboxy-piperidine

28. Isonipecotic Acid, 97%

29. Lopac-i18008

30. 4-piperidincarboxylic Acid

31. Magnesiuml-lactatetrihydrate

32. 4-piperidinylcarboxylic Acid

33. Piperidin-4-carboxylic Acid

34. Lopac0_000705

35. Mls000069407

36. Piperidinecarboxylic Acid-(4)

37. Schembl104297

38. Isonipecotic Acid [mi]

39. Gtpl4227

40. Dtxsid9060100

41. Hms3262m11

42. Hms3887c15

43. Zinc156973

44. Act02073

45. Albb-035134

46. Cs-d1472

47. Hy-y1176

48. Nsc61049

49. Tox21_500705

50. Ab2970

51. Bdbm50000106

52. S5612

53. Stk498304

54. Akos000118858

55. Ab00566

56. Ccg-204790

57. Lp00705

58. Ps-5850

59. Sdccgsbi-0050683.p002

60. Ncgc00015573-01

61. Ncgc00015573-02

62. Ncgc00015573-03

63. Ncgc00015573-04

64. Ncgc00015573-05

65. Ncgc00015573-06

66. Ncgc00093373-02

67. Ncgc00093373-03

68. Ncgc00261390-01

69. Ac-22478

70. Smr000059085

71. Sy001425

72. Db-014830

73. Am20100215

74. Bb 0294867

75. Eu-0100705

76. Ft-0602398

77. I0256

78. I18008

79. Piperidine-4-carboxylic Acid(isonipecotic Acid)

80. Piperidine-4-carboxylic Acid (isonipecotic Acid)

81. Sr-01000075617

82. Sr-01000075617-1

83. W-106001

84. Q15239768

85. F2191-0187

86. 4-piperidinecarboxylic Acid; Hexahydroisonicotinic Acid;h-inp-oh

2.4 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 129.16 g/mol
Molecular Formula C6H11NO2
XLogP3-3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass129.078978594 g/mol
Monoisotopic Mass129.078978594 g/mol
Topological Polar Surface Area49.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity108
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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