CAS 5294-61-1

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6 End Use APIs
12 Related Intermediates

Chemistry

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Also known as: 5294-61-1, N-(2,6-dimethylphenyl)-1-piperazineacetamide, N-(2,6-diphenylmethyl)-1-piperazine acetylamine, N-(2,6-dimethylphenyl)-2-piperazin-1-ylacetamide, Cvt-2738, 1-piperazineacetamide, n-(2,6-dimethylphenyl)-

Molecular Formula

C₁₄H₂₁N₃O

Molecular Weight

247.34 g/mol

InChI Key

NJKRFQIWDJSYOK-UHFFFAOYSA-N

FDA UNII

NYS3I6283H

1 2D Structure

CAS 5294-61-1

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

N-(2,6-dimethylphenyl)-2-piperazin-1-ylacetamide

2.1.2 InChI

InChI=1S/C14H21N3O/c1-11-4-3-5-12(2)14(11)16-13(18)10-17-8-6-15-7-9-17/h3-5,15H,6-10H2,1-2H3,(H,16,18)

2.1.3 InChI Key

NJKRFQIWDJSYOK-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCNCC2

2.2 Other Identifiers

2.2.1 UNII

NYS3I6283H

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 5294-61-1

2. N-(2,6-dimethylphenyl)-1-piperazineacetamide

3. N-(2,6-diphenylmethyl)-1-piperazine Acetylamine

4. N-(2,6-dimethylphenyl)-2-piperazin-1-ylacetamide

5. Cvt-2738

6. 1-piperazineacetamide, N-(2,6-dimethylphenyl)-

7. Unii-nys3i6283h

8. Rs-94287

9. 1-piperazineaceto-2',6'-xylidide

10. Cvt 2738

11. N-(2,6-dimethylphenyl)-2-piperazinylacetamide

12. 1-[n-(2,6-dimethylphenyl)carbamoylmethyl]piperazine

13. Ranolazine Related Compound C

14. Nys3i6283h

15. Ec 610-916-8

16. 4-((2,6-dimethylphenyl)aminocarbonylmethyl)piperazine

17. 4-[(2,6-dimethylphenyl)aminocarbonylmethyl]piperazine

18. Mls000567347

19. 1-[(2,6-dimethylanilino)carbonyl-methyl]-piperazine

20. Schembl1777934

21. 1-[n-(2, 6-dimethylphenyl) Carbamoylmethyl]piperazine

22. Chembl1346682

23. Cvt2738

24. Dtxsid60967408

25. Hms2282g09

26. Act06249

27. Albb-006988

28. Bcp22638

29. Mfcd06384973

30. Stk504225

31. Zinc19976719

32. Akos000266675

33. Unii-nys3i6283hcvt 2738

34. Ac-5903

35. Cs-w010228

36. Fs-2651

37. Smr000154068

38. Am20061064

39. D4319

40. Ft-0635604

41. En300-12208

42. N-(2,6-dimethylpheny)-1-piperazine-acetamide

43. N-(2,6-dimethylphenyl)-2-piperazinoacetamide

44. N-(2,6-dimethylphenyl)-l-piperazineacetamide

45. A24912

46. N-(2, 6-dimethylphenyl)-1-piperazineacetamide

47. N-(2,6-dimethylphenyl)-1-piperazine Acetamide

48. N-(2,6-dimethylphenyl)-1-piperazine-acetamide

49. Ranolazine Related Compound C [usp-rs]

50. 294d611

51. N-(2,6-dimethylphenyl)-piperazin-1-yl-acetamide

52. Q-102800

53. 1-[(2,6-dimethylphenyl)aminocarbonylmethyl]piperazine

54. Q27285110

55. Z85917570

56. 1-[(2,6-dimethylphenyl)aminocarbonylmethyl] Piperazine

57. 2-(1-piperazinyl)-n-(2,6-dimethylphenyl)acetamide (dmpipa)

58. N-(2,6-diphenylmethyl)-1-piperazine Acetylamine;1-[n-(2,6-dimethylphenyl)carbamoylmethyl]piperazine;rz-2;1-(2,6-dimethylphenyl)-1-piperazineacetamide

2.4 Create Date

2005-07-16

3 Chemical and Physical Properties

Molecular Formula	C₁₄H₂₁N₃O
Molecular Weight	247.34 g/mol
XLogP3	1.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	247.168462302 g/mol
Monoisotopic Mass	247.168462302 g/mol
Topological Polar Surface Area	44.4 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	266
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