3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine

C326H398Br8N96O28 — CID 159527460

IUPAC3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine
SMILESC#Cc1cc(Oc2cnc(C)nc2NCC)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(N)nc2NCC(C)=O)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(N)nc2NCc2ccccc2)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC(C)C)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC(CC)CO)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC3CC3)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NCC(C)CO)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NCCC)nc2N)c(C(C)C)cn1.CC(C)Nc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CC(C)c1cnc(Br)cc1Oc1cnc(NC2CC2)nc1N.CC(CO)CNc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CCCNc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CCCNc1ncc(Oc2cc(Br)ncc2C(C)C)c(NCCO)n1.CNc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CNc1ncc(Oc2cc(Br)ncc2C(C)C)c(NC)n1.COc1cc(Oc2cnc(C)nc2N)c(C2(C)CC2)cn1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(NCC(=O)OC(C)(C)C)n1.[2H]C#Cc1cc(Oc2cnc(C)nc2N)c(C(C)C)cn1
InChIInChI=1S/C21H21N5O.C19H25BrN4O3.2C18H23N5O2.C17H24BrN5O2.C17H19N5O2.C17H19N5O.2C17H21N5O.C17H20N4O.C16H22BrN5O2.C15H18BrN5O.2C15H20BrN5O.2C15H17N5O.C15H18N4O2.C15H16N4O.C14H18BrN5O.C13H16BrN5O/c1-4-16-10-18(17(12-23-16)14(2)3)27-19-13-25-21(22)26-20(19)24-11-15-8-6-5-7-9-15;1-11(2)13-8-22-16(20)7-14(13)26-15-9-21-12(3)24-18(15)23-10-17(25)27-19(4,5)6;1-5-13-6-15(14(8-20-13)11(2)3)25-16-9-22-18(23-17(16)19)21-7-12(4)10-24;1-5-12-7-15(14(8-20-12)11(3)4)25-16-9-21-18(23-17(16)19)22-13(6-2)10-24;1-4-5-20-17-22-10-14(16(23-17)19-6-7-24)25-13-8-15(18)21-9-12(13)11(2)3;1-5-12-6-14(13(8-19-12)10(2)3)24-15-9-21-17(18)22-16(15)20-7-11(4)23;1-4-11-7-14(13(8-19-11)10(2)3)23-15-9-20-17(22-16(15)18)21-12-5-6-12;1-6-12-7-14(13(8-19-12)10(2)3)23-15-9-20-17(21-11(4)5)22-16(15)18;1-5-7-19-17-21-10-15(16(18)22-17)23-14-8-12(6-2)20-9-13(14)11(3)4;1-6-13-8-15(14(9-20-13)11(3)4)22-16-10-19-12(5)21-17(16)18-7-2;1-9(2)11-6-19-14(17)4-12(11)24-13-7-21-16(22-15(13)18)20-5-10(3)8-23;1-8(2)10-6-18-13(16)5-11(10)22-12-7-19-15(21-14(12)17)20-9-3-4-9;1-8(2)10-6-18-13(16)5-11(10)22-12-7-19-15(20-9(3)4)21-14(12)17;1-4-5-18-15-20-8-12(14(17)21-15)22-11-6-13(16)19-7-10(11)9(2)3;2*1-5-10-6-12(11(7-18-10)9(2)3)21-13-8-19-15(17-4)20-14(13)16;1-9-17-8-12(14(16)19-9)21-11-6-13(20-3)18-7-10(11)15(2)4-5-15;1-5-11-6-13(12(7-18-11)9(2)3)20-14-8-17-10(4)19-15(14)16;1-8(2)9-6-18-12(15)5-10(9)21-11-7-19-14(17-4)20-13(11)16-3;1-7(2)8-5-17-11(14)4-9(8)20-10-6-18-13(16-3)19-12(10)15/h1,5-10,12-14H,11H2,2-3H3,(H3,22,24,25,26);7-9,11H,10H2,1-6H3,(H,21,23,24);1,6,8-9,11-12,24H,7,10H2,2-4H3,(H3,19,21,22,23);1,7-9,11,13,24H,6,10H2,2-4H3,(H3,19,21,22,23);8-11,24H,4-7H2,1-3H3,(H2,19,20,22,23);1,6,8-10H,7H2,2-4H3,(H3,18,20,21,22);1,7-10,12H,5-6H2,2-3H3,(H3,18,20,21,22);1,7-11H,2-5H3,(H3,18,20,21,22);2,8-11H,5,7H2,1,3-4H3,(H3,18,19,21,22);1,8-11H,7H2,2-5H3,(H,18,19,21);4,6-7,9-10,23H,5,8H2,1-3H3,(H3,18,20,21,22);5-9H,3-4H2,1-2H3,(H3,17,19,20,21);5-9H,1-4H3,(H3,17,19,20,21);6-9H,4-5H2,1-3H3,(H3,17,18,20,21);2*1,6-9H,2-4H3,(H3,16,17,19,20);6-8H,4-5H2,1-3H3,(H2,16,17,19);1,6-9H,2-4H3,(H2,16,17,19);5-8H,1-4H3,(H2,16,17,19,20);4-7H,1-3H3,(H3,15,16,18,19)/i;;;;;;;;;;;;;;;;;1D;;
InChIKeyMCOIIRSNFHZMRI-HMLDHIJLSA-N
MW6749.65 g/mol
LogP64.06
Rot. Bonds109

About 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine

3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine (PubChem CID 159527460) has the molecular formula C326H398Br8N96O28 and a molecular weight of 6749.65 g/mol. Its IUPAC name is 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine
PubChem CID159527460
Molecular FormulaC326H398Br8N96O28
Molecular Weight6749.65 g/mol
Exact Mass6737.62
IUPAC Name3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine
SMILESC#Cc1cc(Oc2cnc(C)nc2NCC)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(N)nc2NCC(C)=O)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(N)nc2NCc2ccccc2)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC(C)C)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC(CC)CO)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC3CC3)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NCC(C)CO)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NCCC)nc2N)c(C(C)C)cn1.CC(C)Nc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CC(C)c1cnc(Br)cc1Oc1cnc(NC2CC2)nc1N.CC(CO)CNc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CCCNc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CCCNc1ncc(Oc2cc(Br)ncc2C(C)C)c(NCCO)n1.CNc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CNc1ncc(Oc2cc(Br)ncc2C(C)C)c(NC)n1.COc1cc(Oc2cnc(C)nc2N)c(C2(C)CC2)cn1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(NCC(=O)OC(C)(C)C)n1.[2H]C#Cc1cc(Oc2cnc(C)nc2N)c(C(C)C)cn1
InChIInChI=1S/C21H21N5O.C19H25BrN4O3.2C18H23N5O2.C17H24BrN5O2.C17H19N5O2.C17H19N5O.2C17H21N5O.C17H20N4O.C16H22BrN5O2.C15H18BrN5O.2C15H20BrN5O.2C15H17N5O.C15H18N4O2.C15H16N4O.C14H18BrN5O.C13H16BrN5O/c1-4-16-10-18(17(12-23-16)14(2)3)27-19-13-25-21(22)26-20(19)24-11-15-8-6-5-7-9-15;1-11(2)13-8-22-16(20)7-14(13)26-15-9-21-12(3)24-18(15)23-10-17(25)27-19(4,5)6;1-5-13-6-15(14(8-20-13)11(2)3)25-16-9-22-18(23-17(16)19)21-7-12(4)10-24;1-5-12-7-15(14(8-20-12)11(3)4)25-16-9-21-18(23-17(16)19)22-13(6-2)10-24;1-4-5-20-17-22-10-14(16(23-17)19-6-7-24)25-13-8-15(18)21-9-12(13)11(2)3;1-5-12-6-14(13(8-19-12)10(2)3)24-15-9-21-17(18)22-16(15)20-7-11(4)23;1-4-11-7-14(13(8-19-11)10(2)3)23-15-9-20-17(22-16(15)18)21-12-5-6-12;1-6-12-7-14(13(8-19-12)10(2)3)23-15-9-20-17(21-11(4)5)22-16(15)18;1-5-7-19-17-21-10-15(16(18)22-17)23-14-8-12(6-2)20-9-13(14)11(3)4;1-6-13-8-15(14(9-20-13)11(3)4)22-16-10-19-12(5)21-17(16)18-7-2;1-9(2)11-6-19-14(17)4-12(11)24-13-7-21-16(22-15(13)18)20-5-10(3)8-23;1-8(2)10-6-18-13(16)5-11(10)22-12-7-19-15(21-14(12)17)20-9-3-4-9;1-8(2)10-6-18-13(16)5-11(10)22-12-7-19-15(20-9(3)4)21-14(12)17;1-4-5-18-15-20-8-12(14(17)21-15)22-11-6-13(16)19-7-10(11)9(2)3;2*1-5-10-6-12(11(7-18-10)9(2)3)21-13-8-19-15(17-4)20-14(13)16;1-9-17-8-12(14(16)19-9)21-11-6-13(20-3)18-7-10(11)15(2)4-5-15;1-5-11-6-13(12(7-18-11)9(2)3)20-14-8-17-10(4)19-15(14)16;1-8(2)9-6-18-12(15)5-10(9)21-11-7-19-14(17-4)20-13(11)16-3;1-7(2)8-5-17-11(14)4-9(8)20-10-6-18-13(16-3)19-12(10)15/h1,5-10,12-14H,11H2,2-3H3,(H3,22,24,25,26);7-9,11H,10H2,1-6H3,(H,21,23,24);1,6,8-9,11-12,24H,7,10H2,2-4H3,(H3,19,21,22,23);1,7-9,11,13,24H,6,10H2,2-4H3,(H3,19,21,22,23);8-11,24H,4-7H2,1-3H3,(H2,19,20,22,23);1,6,8-10H,7H2,2-4H3,(H3,18,20,21,22);1,7-10,12H,5-6H2,2-3H3,(H3,18,20,21,22);1,7-11H,2-5H3,(H3,18,20,21,22);2,8-11H,5,7H2,1,3-4H3,(H3,18,19,21,22);1,8-11H,7H2,2-5H3,(H,18,19,21);4,6-7,9-10,23H,5,8H2,1-3H3,(H3,18,20,21,22);5-9H,3-4H2,1-2H3,(H3,17,19,20,21);5-9H,1-4H3,(H3,17,19,20,21);6-9H,4-5H2,1-3H3,(H3,17,18,20,21);2*1,6-9H,2-4H3,(H3,16,17,19,20);6-8H,4-5H2,1-3H3,(H2,16,17,19);1,6-9H,2-4H3,(H2,16,17,19);5-8H,1-4H3,(H2,16,17,19,20);4-7H,1-3H3,(H3,15,16,18,19)/i;;;;;;;;;;;;;;;;;1D;;
InChIKeyMCOIIRSNFHZMRI-HMLDHIJLSA-N
XLogP64.06
TPSA1748.44 Ų
H-Bond Donors40
H-Bond Acceptors124
Rotatable Bonds109
Heavy Atoms458
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006749.65
LogP ≤ 564.06
H-Bond Donors ≤ 540
H-Bond Acceptors ≤ 10124

Analyze 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine?
The IUPAC name of 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine (CID 159527460) is 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine.
What is the SMILES notation for 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine?
The canonical SMILES for 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine is C#Cc1cc(Oc2cnc(C)nc2NCC)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(N)nc2NCC(C)=O)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(N)nc2NCc2ccccc2)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC(C)C)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC(CC)CO)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NC3CC3)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NCC(C)CO)nc2N)c(C(C)C)cn1.C#Cc1cc(Oc2cnc(NCCC)nc2N)c(C(C)C)cn1.CC(C)Nc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CC(C)c1cnc(Br)cc1Oc1cnc(NC2CC2)nc1N.CC(CO)CNc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CCCNc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CCCNc1ncc(Oc2cc(Br)ncc2C(C)C)c(NCCO)n1.CNc1ncc(Oc2cc(Br)ncc2C(C)C)c(N)n1.CNc1ncc(Oc2cc(Br)ncc2C(C)C)c(NC)n1.COc1cc(Oc2cnc(C)nc2N)c(C2(C)CC2)cn1.Cc1ncc(Oc2cc(Br)ncc2C(C)C)c(NCC(=O)OC(C)(C)C)n1.[2H]C#Cc1cc(Oc2cnc(C)nc2N)c(C(C)C)cn1.
What is the InChIKey of 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine?
The InChIKey is MCOIIRSNFHZMRI-HMLDHIJLSA-N. The full InChI is InChI=1S/C21H21N5O.C19H25BrN4O3.2C18H23N5O2.C17H24BrN5O2.C17H19N5O2.C17H19N5O.2C17H21N5O.C17H20N4O.C16H22BrN5O2.C15H18BrN5O.2C15H20BrN5O.2C15H17N5O.C15H18N4O2.C15H16N4O.C14H18BrN5O.C13H16BrN5O/c1-4-16-10-18(17(12-23-16)14(2)3)27-19-13-25-21(22)26-20(19)24-11-15-8-6-5-7-9-15;1-11(2)13-8-22-16(20)7-14(13)26-15-9-21-12(3)24-18(15)23-10-17(25)27-19(4,5)6;1-5-13-6-15(14(8-20-13)11(2)3)25-16-9-22-18(23-17(16)19)21-7-12(4)10-24;1-5-12-7-15(14(8-20-12)11(3)4)25-16-9-21-18(23-17(16)19)22-13(6-2)10-24;1-4-5-20-17-22-10-14(16(23-17)19-6-7-24)25-13-8-15(18)21-9-12(13)11(2)3;1-5-12-6-14(13(8-19-12)10(2)3)24-15-9-21-17(18)22-16(15)20-7-11(4)23;1-4-11-7-14(13(8-19-11)10(2)3)23-15-9-20-17(22-16(15)18)21-12-5-6-12;1-6-12-7-14(13(8-19-12)10(2)3)23-15-9-20-17(21-11(4)5)22-16(15)18;1-5-7-19-17-21-10-15(16(18)22-17)23-14-8-12(6-2)20-9-13(14)11(3)4;1-6-13-8-15(14(9-20-13)11(3)4)22-16-10-19-12(5)21-17(16)18-7-2;1-9(2)11-6-19-14(17)4-12(11)24-13-7-21-16(22-15(13)18)20-5-10(3)8-23;1-8(2)10-6-18-13(16)5-11(10)22-12-7-19-15(21-14(12)17)20-9-3-4-9;1-8(2)10-6-18-13(16)5-11(10)22-12-7-19-15(20-9(3)4)21-14(12)17;1-4-5-18-15-20-8-12(14(17)21-15)22-11-6-13(16)19-7-10(11)9(2)3;2*1-5-10-6-12(11(7-18-10)9(2)3)21-13-8-19-15(17-4)20-14(13)16;1-9-17-8-12(14(16)19-9)21-11-6-13(20-3)18-7-10(11)15(2)4-5-15;1-5-11-6-13(12(7-18-11)9(2)3)20-14-8-17-10(4)19-15(14)16;1-8(2)9-6-18-12(15)5-10(9)21-11-7-19-14(17-4)20-13(11)16-3;1-7(2)8-5-17-11(14)4-9(8)20-10-6-18-13(16-3)19-12(10)15/h1,5-10,12-14H,11H2,2-3H3,(H3,22,24,25,26);7-9,11H,10H2,1-6H3,(H,21,23,24);1,6,8-9,11-12,24H,7,10H2,2-4H3,(H3,19,21,22,23);1,7-9,11,13,24H,6,10H2,2-4H3,(H3,19,21,22,23);8-11,24H,4-7H2,1-3H3,(H2,19,20,22,23);1,6,8-10H,7H2,2-4H3,(H3,18,20,21,22);1,7-10,12H,5-6H2,2-3H3,(H3,18,20,21,22);1,7-11H,2-5H3,(H3,18,20,21,22);2,8-11H,5,7H2,1,3-4H3,(H3,18,19,21,22);1,8-11H,7H2,2-5H3,(H,18,19,21);4,6-7,9-10,23H,5,8H2,1-3H3,(H3,18,20,21,22);5-9H,3-4H2,1-2H3,(H3,17,19,20,21);5-9H,1-4H3,(H3,17,19,20,21);6-9H,4-5H2,1-3H3,(H3,17,18,20,21);2*1,6-9H,2-4H3,(H3,16,17,19,20);6-8H,4-5H2,1-3H3,(H2,16,17,19);1,6-9H,2-4H3,(H2,16,17,19);5-8H,1-4H3,(H2,16,17,19,20);4-7H,1-3H3,(H3,15,16,18,19)/i;;;;;;;;;;;;;;;;;1D;;.
What are the key properties of 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine?
3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine has a molecular weight of 6749.65 g/mol, XLogP of 64.06, 109 rotatable bonds, 40 hydrogen bond donors, and 124 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-amino-5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;2-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]butan-1-ol;3-[[4-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-2-yl]amino]-2-methylpropan-1-ol;1-[[2-amino-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-yl]amino]propan-2-one;4-N-benzyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-cyclopropylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N,4-N-dimethylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-(propylamino)pyrimidin-4-yl]amino]ethanol;5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;tert-butyl 2-[[5-[(2-bromo-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-yl]amino]acetate;2-N-cyclopropyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidine-2,4-diamine;5-[[2-(2-deuterioethynyl)-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine;N-ethyl-5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-methylpyrimidin-4-amine;bis(5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-methylpyrimidine-2,4-diamine);5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propan-2-ylpyrimidine-2,4-diamine;5-[(2-ethynyl-5-propan-2-yl-4-pyridinyl)oxy]-2-N-propylpyrimidine-2,4-diamine;5-[[2-methoxy-5-(1-methylcyclopropyl)-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine is sourced from PubChem (CID 159527460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).