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Overview of 3-(N-Methylpentylamino)Propionic Acid HCl

Client Email Product
4CH-018104
PharmaCompass
4CH-018104
Also known as: 625120-81-2, 3-(methyl(pentyl)amino)propanoic acid hydrochloride, 3-(n-methylpentylamino)propionic acid hydrochloride, 3-(n-methylpentylamino)propionic acid hcl, 3-[methyl(pentyl)amino]propanoic acid hydrochloride, 3-(n-methyl-n-pentylamino)propionic acid hydrochloride
Molecular Formula
C9H20ClNO2
Molecular Weight
209.714  g/mol
InChI Key
YDWXRULMHQZBEX-UHFFFAOYSA-N

1 2D Structure

4CH-018104

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-[methyl(pentyl)amino]propanoic acid;hydrochloride
2.1.2 InChI
InChI=1S/C9H19NO2.ClH/c1-3-4-5-7-10(2)8-6-9(11)12;/h3-8H2,1-2H3,(H,11,12);1H
2.1.3 InChI Key
YDWXRULMHQZBEX-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCCCCN(C)CCC(=O)O.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 625120-81-2

2. 3-(methyl(pentyl)amino)propanoic Acid Hydrochloride

3. 3-(n-methylpentylamino)propionic Acid Hydrochloride

4. 3-(n-methylpentylamino)propionic Acid Hcl

5. 3-[methyl(pentyl)amino]propanoic Acid Hydrochloride

6. 3-(n-methyl-n-pentylamino)propionic Acid Hydrochloride

7. Ak-35893

8. 3-(n-methylpentylamino)propionicacidhydrochloride

9. 3-[methyl(pentyl)amino]propanoic Acid;hydrochloride

10. Ibanic Acid Hydrochloride

11. 3- Propionicacidhydrochloride

12. Ibandronic Acid Impurity Hcl

13. Ksc496m0p

14. Schembl369126

15. Ctk3j6607

16. Ks-00000fng

17. Dtxsid20587383

18. Molport-005-940-316

19. Anw-46132

20. Mfcd08275216

21. Sbb067052

22. Akos015900387

23. Cm-1233

24. Rp26528

25. (r)-4-benzoxycarbonyl-2-methylpiperazine

26. Ac-25861

27. An-27797

28. As-15812

29. Lp052195

30. Or004591

31. Q872

32. Sc-19427

33. 3-(methyl(pentyl)amino)propanoic Acid Hcl

34. N-methyl-n-pentyl-beta-alaninehydrochloride

35. Ax8011435

36. Kb-178600

37. N-methyl-n-pentyl-

38. A-alanine Hydrochloride

39. Rt-003118

40. St2404823

41. (3r)-1-benzyloxycarbonyl-3-methylpiperazine

42. 3-(n-methylpentylamino) Propionic Acid Hcl

43. 4ch-018104

44. Ft-0648280

45. N-methyl-n-pentyl-beta-alanine Hydrochloride

46. M-2108

47. 3-(methyl(pentyl)amino)propanoicacidhydrochloride

48. 120m812

49. 3-(n-methylpentylamino)propionic Acidhydrochloride

50. 3-(n-methylpentylamino)propanoic Acid Hydrochloride

51. I14-0818

52. J-510919

53. 3-(n-methyl-n-pentylamino)propanoic Acid Hydrochloride

54. Beta-alanine, N-methyl-n-pentyl-, Hydrochloride (1:1)

55. N-methyl-n-pentyl-beta-alanine--hydrogen Chloride (1/1)

2.3 Create Date
2007-09-10
3 Chemical and Physical Properties
Molecular Weight 209.714 g/mol
Molecular Formula C9H20ClNO2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass209.118 g/mol
Monoisotopic Mass209.118 g/mol
Topological Polar Surface Area40.5 A^2
Heavy Atom Count13
Formal Charge0
Complexity126
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
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