2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine

C200H210N74O15 — CID 157254145

IUPAC2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine
SMILESC.C.CC(C)(O)Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)c(C#N)c5)nc4)CCC3)no2)cn1.CN(C)C(=O)Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(C)c5)n4)CCC3)cn2)cn1.CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(CC#N)c5)n4)CCC3)cn2)cn1.CNc1ncc(-c2ccc(C3(c4noc(-c5cnn(CC(C)(C)O)c5)n4)CCC3)cn2)cn1.Cc1nc(N)cnc1-c1ccc(C2(c3noc(-c4cnn(CC(C)(C)O)c4)n3)CCC2)cn1.Cc1nc(N)ncc1-c1ccc(C2(c3noc(-c4cnn(CC(C)(C)O)c4)n3)CCC2)cn1.Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.N#Cc1cc(-c2ccc(C3(c4noc(-c5cnn(C6COC6)c5)n4)CCC3)cn2)cnc1N
InChIInChI=1S/C24H24N8O2.C23H20N8O2.3C23H26N8O2.C22H23N9O2.C21H19N9O.C20H20N8O.C19H18N8O.2CH4/c1-23(2,33)14-32-13-17(11-29-32)21-30-22(31-34-21)24(6-3-7-24)18-4-5-19(27-12-18)16-8-15(9-25)20(26)28-10-16;24-7-14-6-15(8-27-20(14)25)19-3-2-17(10-26-19)23(4-1-5-23)22-29-21(33-30-22)16-9-28-31(11-16)18-12-32-13-18;1-22(2,32)14-31-13-16(11-28-31)19-29-20(30-33-19)23(7-4-8-23)17-5-6-18(25-12-17)15-9-26-21(24-3)27-10-15;1-14-17(11-26-21(24)28-14)18-6-5-16(10-25-18)23(7-4-8-23)20-29-19(33-30-20)15-9-27-31(12-15)13-22(2,3)32;1-14-19(26-11-18(24)28-14)17-6-5-16(10-25-17)23(7-4-8-23)21-29-20(33-30-21)15-9-27-31(12-15)13-22(2,3)32;1-30(2)19(32)13-31-12-14(8-27-31)20-28-21(29-33-20)22(6-3-7-22)15-4-5-16(24-9-15)17-10-26-18(23)11-25-17;1-23-18-12-25-17(11-26-18)16-4-3-15(10-24-16)21(5-2-6-21)20-28-19(31-29-20)14-9-27-30(13-14)8-7-22;1-21-17-11-23-16(10-24-17)15-5-4-14(9-22-15)20(6-3-7-20)19-26-18(29-27-19)13-8-25-28(2)12-13;1-27-11-12(7-24-27)17-25-18(26-28-17)19(5-2-6-19)13-3-4-14(21-8-13)15-9-23-16(20)10-22-15;;/h4-5,8,10-13,33H,3,6-7,14H2,1-2H3,(H2,26,28);2-3,6,8-11,18H,1,4-5,12-13H2,(H2,25,27);5-6,9-13,32H,4,7-8,14H2,1-3H3,(H,24,26,27);5-6,9-12,32H,4,7-8,13H2,1-3H3,(H2,24,26,28);5-6,9-12,32H,4,7-8,13H2,1-3H3,(H2,24,28);4-5,8-12H,3,6-7,13H2,1-2H3,(H2,23,26);3-4,9-13H,2,5-6,8H2,1H3,(H,23,26);4-5,8-12H,3,6-7H2,1-2H3,(H,21,24);3-4,7-11H,2,5-6H2,1H3,(H2,20,23);2*1H4
InChIKeyAWRMSLFIPGCSJM-UHFFFAOYSA-N
MW3890.38 g/mol
LogP26.10
Rot. Bonds51

About 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine

2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine (PubChem CID 157254145) has the molecular formula C200H210N74O15 and a molecular weight of 3890.38 g/mol. Its IUPAC name is 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine.

Molecular Properties

Compound Name2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine
PubChem CID157254145
Molecular FormulaC200H210N74O15
Molecular Weight3890.38 g/mol
Exact Mass3887.79
IUPAC Name2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine
SMILESC.C.CC(C)(O)Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)c(C#N)c5)nc4)CCC3)no2)cn1.CN(C)C(=O)Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(C)c5)n4)CCC3)cn2)cn1.CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(CC#N)c5)n4)CCC3)cn2)cn1.CNc1ncc(-c2ccc(C3(c4noc(-c5cnn(CC(C)(C)O)c5)n4)CCC3)cn2)cn1.Cc1nc(N)cnc1-c1ccc(C2(c3noc(-c4cnn(CC(C)(C)O)c4)n3)CCC2)cn1.Cc1nc(N)ncc1-c1ccc(C2(c3noc(-c4cnn(CC(C)(C)O)c4)n3)CCC2)cn1.Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.N#Cc1cc(-c2ccc(C3(c4noc(-c5cnn(C6COC6)c5)n4)CCC3)cn2)cnc1N
InChIInChI=1S/C24H24N8O2.C23H20N8O2.3C23H26N8O2.C22H23N9O2.C21H19N9O.C20H20N8O.C19H18N8O.2CH4/c1-23(2,33)14-32-13-17(11-29-32)21-30-22(31-34-21)24(6-3-7-24)18-4-5-19(27-12-18)16-8-15(9-25)20(26)28-10-16;24-7-14-6-15(8-27-20(14)25)19-3-2-17(10-26-19)23(4-1-5-23)22-29-21(33-30-22)16-9-28-31(11-16)18-12-32-13-18;1-22(2,32)14-31-13-16(11-28-31)19-29-20(30-33-19)23(7-4-8-23)17-5-6-18(25-12-17)15-9-26-21(24-3)27-10-15;1-14-17(11-26-21(24)28-14)18-6-5-16(10-25-18)23(7-4-8-23)20-29-19(33-30-20)15-9-27-31(12-15)13-22(2,3)32;1-14-19(26-11-18(24)28-14)17-6-5-16(10-25-17)23(7-4-8-23)21-29-20(33-30-21)15-9-27-31(12-15)13-22(2,3)32;1-30(2)19(32)13-31-12-14(8-27-31)20-28-21(29-33-20)22(6-3-7-22)15-4-5-16(24-9-15)17-10-26-18(23)11-25-17;1-23-18-12-25-17(11-26-18)16-4-3-15(10-24-16)21(5-2-6-21)20-28-19(31-29-20)14-9-27-30(13-14)8-7-22;1-21-17-11-23-16(10-24-17)15-5-4-14(9-22-15)20(6-3-7-20)19-26-18(29-27-19)13-8-25-28(2)12-13;1-27-11-12(7-24-27)17-25-18(26-28-17)19(5-2-6-19)13-3-4-14(21-8-13)15-9-23-16(20)10-22-15;;/h4-5,8,10-13,33H,3,6-7,14H2,1-2H3,(H2,26,28);2-3,6,8-11,18H,1,4-5,12-13H2,(H2,25,27);5-6,9-13,32H,4,7-8,14H2,1-3H3,(H,24,26,27);5-6,9-12,32H,4,7-8,13H2,1-3H3,(H2,24,26,28);5-6,9-12,32H,4,7-8,13H2,1-3H3,(H2,24,28);4-5,8-12H,3,6-7,13H2,1-2H3,(H2,23,26);3-4,9-13H,2,5-6,8H2,1H3,(H,23,26);4-5,8-12H,3,6-7H2,1-2H3,(H,21,24);3-4,7-11H,2,5-6H2,1H3,(H2,20,23);2*1H4
InChIKeyAWRMSLFIPGCSJM-UHFFFAOYSA-N
XLogP26.10
TPSA1206.95 Ų
H-Bond Donors13
H-Bond Acceptors88
Rotatable Bonds51
Heavy Atoms289
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003890.38
LogP ≤ 526.10
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1088

Analyze 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine with MolForge

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What is the IUPAC name of 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine?
The IUPAC name of 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine (CID 157254145) is 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine.
What is the SMILES notation for 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine?
The canonical SMILES for 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine is C.C.CC(C)(O)Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)c(C#N)c5)nc4)CCC3)no2)cn1.CN(C)C(=O)Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(C)c5)n4)CCC3)cn2)cn1.CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(CC#N)c5)n4)CCC3)cn2)cn1.CNc1ncc(-c2ccc(C3(c4noc(-c5cnn(CC(C)(C)O)c5)n4)CCC3)cn2)cn1.Cc1nc(N)cnc1-c1ccc(C2(c3noc(-c4cnn(CC(C)(C)O)c4)n3)CCC2)cn1.Cc1nc(N)ncc1-c1ccc(C2(c3noc(-c4cnn(CC(C)(C)O)c4)n3)CCC2)cn1.Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.N#Cc1cc(-c2ccc(C3(c4noc(-c5cnn(C6COC6)c5)n4)CCC3)cn2)cnc1N.
What is the InChIKey of 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine?
The InChIKey is AWRMSLFIPGCSJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N8O2.C23H20N8O2.3C23H26N8O2.C22H23N9O2.C21H19N9O.C20H20N8O.C19H18N8O.2CH4/c1-23(2,33)14-32-13-17(11-29-32)21-30-22(31-34-21)24(6-3-7-24)18-4-5-19(27-12-18)16-8-15(9-25)20(26)28-10-16;24-7-14-6-15(8-27-20(14)25)19-3-2-17(10-26-19)23(4-1-5-23)22-29-21(33-30-22)16-9-28-31(11-16)18-12-32-13-18;1-22(2,32)14-31-13-16(11-28-31)19-29-20(30-33-19)23(7-4-8-23)17-5-6-18(25-12-17)15-9-26-21(24-3)27-10-15;1-14-17(11-26-21(24)28-14)18-6-5-16(10-25-18)23(7-4-8-23)20-29-19(33-30-20)15-9-27-31(12-15)13-22(2,3)32;1-14-19(26-11-18(24)28-14)17-6-5-16(10-25-17)23(7-4-8-23)21-29-20(33-30-21)15-9-27-31(12-15)13-22(2,3)32;1-30(2)19(32)13-31-12-14(8-27-31)20-28-21(29-33-20)22(6-3-7-22)15-4-5-16(24-9-15)17-10-26-18(23)11-25-17;1-23-18-12-25-17(11-26-18)16-4-3-15(10-24-16)21(5-2-6-21)20-28-19(31-29-20)14-9-27-30(13-14)8-7-22;1-21-17-11-23-16(10-24-17)15-5-4-14(9-22-15)20(6-3-7-20)19-26-18(29-27-19)13-8-25-28(2)12-13;1-27-11-12(7-24-27)17-25-18(26-28-17)19(5-2-6-19)13-3-4-14(21-8-13)15-9-23-16(20)10-22-15;;/h4-5,8,10-13,33H,3,6-7,14H2,1-2H3,(H2,26,28);2-3,6,8-11,18H,1,4-5,12-13H2,(H2,25,27);5-6,9-13,32H,4,7-8,14H2,1-3H3,(H,24,26,27);5-6,9-12,32H,4,7-8,13H2,1-3H3,(H2,24,26,28);5-6,9-12,32H,4,7-8,13H2,1-3H3,(H2,24,28);4-5,8-12H,3,6-7,13H2,1-2H3,(H2,23,26);3-4,9-13H,2,5-6,8H2,1H3,(H,23,26);4-5,8-12H,3,6-7H2,1-2H3,(H,21,24);3-4,7-11H,2,5-6H2,1H3,(H2,20,23);2*1H4.
What are the key properties of 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine?
2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine has a molecular weight of 3890.38 g/mol, XLogP of 26.10, 51 rotatable bonds, 13 hydrogen bond donors, and 88 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[5-[1-[5-[1-(2-hydroxy-2-methylpropyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;1-[4-[3-[1-[6-(5-amino-3-methylpyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[4-[3-[1-[6-(2-amino-4-methylpyrimidin-5-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;2-amino-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyridine-3-carbonitrile;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-N,N-dimethylacetamide;methane;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;2-methyl-1-[4-[3-[1-[6-[2-(methylamino)pyrimidin-5-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]propan-2-ol;N-methyl-5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;5-[5-[1-[5-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine is sourced from PubChem (CID 157254145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).