MolPort-000-929-455

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Also known as: 2955-88-6, N-(2-hydroxyethyl)pyrrolidine, Epolamine, 1-(2-hydroxyethyl)pyrrolidine, 2-(pyrrolidin-1-yl)ethanol, 2-pyrrolidin-1-ylethanol

Molecular Formula

C₆H₁₃NO

Molecular Weight

115.17 g/mol

InChI Key

XBRDBODLCHKXHI-UHFFFAOYSA-N

FDA UNII

R3D835XVCR

1 2D Structure

MolPort-000-929-455

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-pyrrolidin-1-ylethanol

2.1.2 InChI

InChI=1S/C6H13NO/c8-6-5-7-3-1-2-4-7/h8H,1-6H2

2.1.3 InChI Key

XBRDBODLCHKXHI-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CCN(C1)CCO

2.2 Other Identifiers

2.2.1 UNII

R3D835XVCR

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Epolamine

2. Epolamine Hydrochloride

3. N-(2-hydroxyethyl)-2,5-(14c)-pyrrolidine

4. N-(2-hydroxyethyl)pyrrolidine

2.3.2 Depositor-Supplied Synonyms

1. 2955-88-6

2. N-(2-hydroxyethyl)pyrrolidine

3. Epolamine

4. 1-(2-hydroxyethyl)pyrrolidine

5. 2-(pyrrolidin-1-yl)ethanol

6. 2-pyrrolidin-1-ylethanol

7. 2-pyrrolidinoethanol

8. Pyrrolidinoethanol

9. Hydroxyethylpyrrolidine

10. Epolamine [inn]

11. 2-(1-pyrrolidinyl)ethanol

12. 2-(pyrrolidin-1-yl)ethan-1-ol

13. 2-pyrrolidin-1-yl-ethanol

14. N-beta-hydroxyethylpyrrolidine

15. Pyrrolidine-1-ethanol

16. Mfcd00003181

17. R3d835xvcr

18. Hep

19. Chebi:48293

20. N-.beta.-hydroxyethylpyrrolidine

21. Nsc-26883

22. 1-pyrrolidinoethanol

23. 2-(1-pyrrolidino)ethanol

24. N-(beta-hydroxyethyl)pyrrolidine

25. Einecs 220-976-3

26. Unii-r3d835xvcr

27. Ai3-62298

28. 1-(2-hydroxyethyl)-pyrrolidine

29. Pyrrolidin Ethanol

30. 2-pyrrolidino-ethanol

31. N-hydroxyethylpyrrolidine

32. 2-hydroxyethylpyrrolidine

33. 2-pyrolidin-1-yl-ethanol

34. Ec 220-976-3

35. N-2-hydroxyethylpyrrolidine

36. Schembl8387

37. 2-pyrrolidine-1-yl-ethanol

38. 1-(2-hydroxyethyl)pyrrolidin

39. 2-(pyrrolidine-1-yl)ethanol

40. Mls006011501

41. N-(2-hydroxethyl)pyrrolidine

42. 2-(1-pyrrolidinyl)ethanol #

43. 1-(2-hydroxylethyl)pyrrolidine

44. Chembl122581

45. N-(beta-hydroxyethyl)pyrolidine

46. 1-(2-hydroxy-ethyl)pyrrolidine

47. 1-(2-hydroxyethyl) Pyrrolidine

48. 1-(2-hydroxy Ethyl)-pyrrolidine

49. 2-hydroxyethyl Pyrrolidine

50. Dtxsid70183733

51. Zinc388750

52. Nsc26883

53. Bbl027420

54. Nsc 26883

55. Stk803090

56. 1-(2-hydroxyethyl)pyrrolidine, 97%

57. Akos000120265

58. Cs-w011235

59. Sb14610

60. Ac-18883

61. As-12255

62. Smr004703280

63. Db-030071

64. Am20090391

65. Ft-0613402

66. H0479

67. F14228

68. 955h886

69. A819962

70. Sr-01000944723

71. Q-100373

72. Sr-01000944723-1

73. Q27121124

74. Z197268862

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₆H₁₃NO
Molecular Weight	115.17 g/mol
XLogP3	0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	115.099714038 g/mol
Monoisotopic Mass	115.099714038 g/mol
Topological Polar Surface Area	23.5 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	59.5
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1