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CAS 152460-10-1
PharmaCompass
CAS 152460-10-1
Also known as: 152460-10-1, N-(5-amino-2-methylphenyl)-4-(3-pyridyl)-2-pyrimidineamine, 6-methyl-n1-(4-(pyridin-3-yl)pyrimidin-2-yl)benzene-1,3-diamine, 2-(5-amino-2-methylanilino)-4-(3-pyridyl)pyrimidine, Chembl278103, 4-methyl-n3-[4-(3-pyridinyl)-2-pyrimidinyl]-1,3-benzenediamine
Molecular Formula
C16H15N5
Molecular Weight
277.331  g/mol
InChI Key
QGAIPGVQJVGBIA-UHFFFAOYSA-N

1 2D Structure

CAS 152460-10-1

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-methyl-3-N-(4-pyridin-3-ylpyrimidin-2-yl)benzene-1,3-diamine
2.1.2 InChI
InChI=1S/C16H15N5/c1-11-4-5-13(17)9-15(11)21-16-19-8-6-14(20-16)12-3-2-7-18-10-12/h2-10H,17H2,1H3,(H,19,20,21)
2.1.3 InChI Key
QGAIPGVQJVGBIA-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C(C=C(C=C1)N)NC2=NC=CC(=N2)C3=CN=CC=C3
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 152460-10-1

2. N-(5-amino-2-methylphenyl)-4-(3-pyridyl)-2-pyrimidineamine

3. 6-methyl-n1-(4-(pyridin-3-yl)pyrimidin-2-yl)benzene-1,3-diamine

4. 2-(5-amino-2-methylanilino)-4-(3-pyridyl)pyrimidine

5. Chembl278103

6. 4-methyl-n3-[4-(3-pyridinyl)-2-pyrimidinyl]-1,3-benzenediamine

7. Ak-23922

8. N-(5-amino-2-methylphenyl)-4-(3-pyridinyl)-2-pyrimidineamine

9. Q-100177

10. F9995-0188

11. 1,3-benzenediamine, 4-methyl-n3-[4-(3-pyridinyl)-2-pyrimidinyl]-

12. 4-methyl-n*3*-(4-pyridin-3-yl-pyrimidin-2-yl)-benzene-1,3-diamine

13. 6-methyl-n1-[4-(pyridin-3-yl)pyrimidin-2-yl]benzene-1,3-diamine

14. N-(5-amino-2-methylphenyl)-4-(3-pridyl)-2-pyrimidineamine

15. Zlchem 1354

16. Pubchem18212

17. Acmc-209d7r

18. Schembl2392

19. Ksc174k2p

20. Ben021

21. Jsp002938

22. Ctk0h4527

23. Dtxsid30433443

24. Zle0132

25. Molport-003-889-278

26. Qgaipgvqjvgbia-uhfffaoysa-n

27. Act04895

28. Ac-619

29. Anw-21397

30. Bdbm50287097

31. Ca0157

32. Mfcd09028125

33. Zinc21985310

34. Akos015888614

35. Ac-2147

36. Acn-026829

37. An-7039

38. Cs-w014568

39. Ds-0284

40. Ls41060

41. Mcule-2150821496

42. Qc-1118

43. Rp29768

44. Rtx-011154

45. Tra-0195164

46. 112gi007

47. Aj-79342

48. At-20154

49. Br-23922

50. Cj-17093

51. He057095

52. He130312

53. Kb-56035

54. R756

55. Sc-19340

56. Ab0005260

57. Ab1004617

58. Ax8008693

59. Db-011615

60. 4ch-006386

61. Am20050827

62. Ft-0083543

63. Ft-0647597

64. Ft-0655675

65. Ft-0696298

66. St24033278

67. Vu0549314-1

68. M-1404

69. 460a101

70. I01-1233

71. I14-2828

72. N-(5-amino-2-methylphenyl)-4-(3-pyridyl)-2-pyrimid

73. 4-methyl-3-[4-(3-pyridyl)pyrimidin-2-ylamino]aniline

74. 3-[[4-(3-pyridinyl)pyrimidine-2-yl]amino]-4-methylaniline

75. N-(2-methyl-5-aminophenyl)-4-(3-pyridyl)-2-pyrimidine Amine

76. N-(5-amino-2-methyl Phenyl)-4-(3-pyridyl)-2-pyrimidineamine

77. N-(5-amino-2-methylphenyl)-4-(3-pyridyl)-2- Pyrimidineamine

78. N-(5-amino-2-methylphenyl)-4-(3-pyridyl)-2-pyrimidinamine

79. N-(5-amino-2-methylphenyl)-4-(3-pyridyl)-2-pyrimidine Amine

80. N-(5-amino-2-methylphenyl)-4-(3-pyridyl)-2-pyrimidine-amine

81. 1,3-benzenediamine, 4-methyl-n3-[4-(3-pyridinyl)-2-pyrimidinyl

82. 4-methyl-3-n-(4-pyridin-3-ylpyrimidin-2-yl)benzene-1,3-diamine

83. 4-methyl-n-3-(4-(pyridin-3-yl)pyrimidin-2-yl)benzene-1,3-diamine

84. 4-methyl-n~3~-(4-pyridin-3-ylpyrimidin-2-yl)benzene-1,3-diamine

85. 4-methyl-n3-(4-pyridin-3-yl-pyrimidin-2-yl)-benzene-1,3-diamine

86. 4-methyl-n3-[4-(3-piridinyl)-2-pirimidinyl]-1,3-benzendiamine

87. 4-methyl-n3-[4-(3-pyridyl)-2-pyrimidinyl]-1,3-phenylenediamine

88. 4-methyl-n3-[4-(3-pyridyl)pyrimidin-2-yl]benzene-1,3-diamine

89. 4-methyl-n3-[4-(pyridin-3-yl)pyrimidin-2-yl]benzene-1,3-diamine

90. 6-methyl-1-n-[4-(pyridin-3-yl)pyrimidin-2-yl]benzene-1,3-diamine

91. 6-methyl-n-(4-(pyridine-3-yl)pyrimidin-2-yl)benzene-1,3-diamine

92. 6-methyl-n1-(4-(pyridine-3-yl)pyrimidin-2-yl)benzene-1,2-diamine

93. N-(5-amino-2-methyl Phenyl)-4-(3-pyridinyl)2-pyrimidine-amine

94. N-(5-amino-2-methylphenyl)-4-(3-pyridinyl)-2-pyrimidine-amine

95. 4-methyl-n~3~-[4-(pyridin-3-yl)pyrimidin-2-yl]benzene-1,3-diamine

96. 4-methyl-n3-[4-(3-pyridyl)-2-pyrimidinyl]-1,3-phenylenediamine; N-(5-amino-o-tolyl)-4-(3-pyridyl)-2-pyrimidinamine

2.3 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 277.331 g/mol
Molecular Formula C16H15N5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass277.133 g/mol
Monoisotopic Mass277.133 g/mol
Topological Polar Surface Area76.7 A^2
Heavy Atom Count21
Formal Charge0
Complexity324
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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