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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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

C148H146N58O11 — CID 157454958

IUPAC1-[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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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
SMILESCNc1cnc(-c2ccc(C3(c4noc(-c5cnn(C6COC6)c5)n4)CCC3)cn2)cn1.CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(CC#N)c5)n4)CCC3)cn2)cn1.COCCn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.Cc1nc(N)cnc1-c1ccc(C2(c3noc(-c4cnn(C5COC5)c4)n3)CCC2)cn1.Cc1nc(N)cnc1-c1ccc(C2(c3noc(-c4cnn(CC(C)(C)O)c4)n3)CCC2)cn1.Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.N#CCn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1
InChIInChI=1S/C23H26N8O2.2C22H22N8O2.C21H19N9O.C21H22N8O2.C20H17N9O.C19H18N8O/c1-14-19(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;1-23-19-10-25-18(9-26-19)17-4-3-15(8-24-17)22(5-2-6-22)21-28-20(32-29-21)14-7-27-30(11-14)16-12-31-13-16;1-13-19(25-9-18(23)27-13)17-4-3-15(8-24-17)22(5-2-6-22)21-28-20(32-29-21)14-7-26-30(10-14)16-11-31-12-16;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;1-30-8-7-29-13-14(9-26-29)19-27-20(28-31-19)21(5-2-6-21)15-3-4-16(23-10-15)17-11-25-18(22)12-24-17;21-6-7-29-12-13(8-26-29)18-27-19(28-30-18)20(4-1-5-20)14-2-3-15(23-9-14)16-10-25-17(22)11-24-16;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/h5-6,9-12,32H,4,7-8,13H2,1-3H3,(H2,24,28);3-4,7-11,16H,2,5-6,12-13H2,1H3,(H,23,26);3-4,7-10,16H,2,5-6,11-12H2,1H3,(H2,23,27);3-4,9-13H,2,5-6,8H2,1H3,(H,23,26);3-4,9-13H,2,5-8H2,1H3,(H2,22,25);2-3,8-12H,1,4-5,7H2,(H2,22,25);3-4,7-11H,2,5-6H2,1H3,(H2,20,23)
InChIKeyBTGBCZBNQZTJRJ-UHFFFAOYSA-N
MW2913.19 g/mol
LogP18.54
Rot. Bonds39

About 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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

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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 157454958) has the molecular formula C148H146N58O11 and a molecular weight of 2913.19 g/mol. Its IUPAC name is 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 Name1-[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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 CID157454958
Molecular FormulaC148H146N58O11
Molecular Weight2913.19 g/mol
Exact Mass2911.26
IUPAC Name1-[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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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
SMILESCNc1cnc(-c2ccc(C3(c4noc(-c5cnn(C6COC6)c5)n4)CCC3)cn2)cn1.CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(CC#N)c5)n4)CCC3)cn2)cn1.COCCn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.Cc1nc(N)cnc1-c1ccc(C2(c3noc(-c4cnn(C5COC5)c4)n3)CCC2)cn1.Cc1nc(N)cnc1-c1ccc(C2(c3noc(-c4cnn(CC(C)(C)O)c4)n3)CCC2)cn1.Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.N#CCn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1
InChIInChI=1S/C23H26N8O2.2C22H22N8O2.C21H19N9O.C21H22N8O2.C20H17N9O.C19H18N8O/c1-14-19(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;1-23-19-10-25-18(9-26-19)17-4-3-15(8-24-17)22(5-2-6-22)21-28-20(32-29-21)14-7-27-30(11-14)16-12-31-13-16;1-13-19(25-9-18(23)27-13)17-4-3-15(8-24-17)22(5-2-6-22)21-28-20(32-29-21)14-7-26-30(10-14)16-11-31-12-16;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;1-30-8-7-29-13-14(9-26-29)19-27-20(28-31-19)21(5-2-6-21)15-3-4-16(23-10-15)17-11-25-18(22)12-24-17;21-6-7-29-12-13(8-26-29)18-27-19(28-30-18)20(4-1-5-20)14-2-3-15(23-9-14)16-10-25-17(22)11-24-16;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/h5-6,9-12,32H,4,7-8,13H2,1-3H3,(H2,24,28);3-4,7-11,16H,2,5-6,12-13H2,1H3,(H,23,26);3-4,7-10,16H,2,5-6,11-12H2,1H3,(H2,23,27);3-4,9-13H,2,5-6,8H2,1H3,(H,23,26);3-4,9-13H,2,5-8H2,1H3,(H2,22,25);2-3,8-12H,1,4-5,7H2,(H2,22,25);3-4,7-11H,2,5-6H2,1H3,(H2,20,23)
InChIKeyBTGBCZBNQZTJRJ-UHFFFAOYSA-N
XLogP18.54
TPSA917.53 Ų
H-Bond Donors8
H-Bond Acceptors69
Rotatable Bonds39
Heavy Atoms217
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002913.19
LogP ≤ 518.54
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1069

Analyze 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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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Frequently Asked Questions

What is the IUPAC name of 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 157454958) is 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(C6COC6)c5)n4)CCC3)cn2)cn1.CNc1cnc(-c2ccc(C3(c4noc(-c5cnn(CC#N)c5)n4)CCC3)cn2)cn1.COCCn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.Cc1nc(N)cnc1-c1ccc(C2(c3noc(-c4cnn(C5COC5)c4)n3)CCC2)cn1.Cc1nc(N)cnc1-c1ccc(C2(c3noc(-c4cnn(CC(C)(C)O)c4)n3)CCC2)cn1.Cn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.N#CCn1cc(-c2nc(C3(c4ccc(-c5cnc(N)cn5)nc4)CCC3)no2)cn1.
What is the InChIKey of 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 BTGBCZBNQZTJRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N8O2.2C22H22N8O2.C21H19N9O.C21H22N8O2.C20H17N9O.C19H18N8O/c1-14-19(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;1-23-19-10-25-18(9-26-19)17-4-3-15(8-24-17)22(5-2-6-22)21-28-20(32-29-21)14-7-27-30(11-14)16-12-31-13-16;1-13-19(25-9-18(23)27-13)17-4-3-15(8-24-17)22(5-2-6-22)21-28-20(32-29-21)14-7-26-30(10-14)16-11-31-12-16;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;1-30-8-7-29-13-14(9-26-29)19-27-20(28-31-19)21(5-2-6-21)15-3-4-16(23-10-15)17-11-25-18(22)12-24-17;21-6-7-29-12-13(8-26-29)18-27-19(28-30-18)20(4-1-5-20)14-2-3-15(23-9-14)16-10-25-17(22)11-24-16;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/h5-6,9-12,32H,4,7-8,13H2,1-3H3,(H2,24,28);3-4,7-11,16H,2,5-6,12-13H2,1H3,(H,23,26);3-4,7-10,16H,2,5-6,11-12H2,1H3,(H2,23,27);3-4,9-13H,2,5-6,8H2,1H3,(H,23,26);3-4,9-13H,2,5-8H2,1H3,(H2,22,25);2-3,8-12H,1,4-5,7H2,(H2,22,25);3-4,7-11H,2,5-6H2,1H3,(H2,20,23).
What are the key properties of 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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?
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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 2913.19 g/mol, XLogP of 18.54, 39 rotatable bonds, 8 hydrogen bond donors, and 69 hydrogen bond acceptors.
Where does this data come from?
All data for 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;2-[4-[3-[1-[6-(5-aminopyrazin-2-yl)-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;5-[5-[1-[5-[1-(2-methoxyethyl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;2-[4-[3-[1-[6-[5-(methylamino)pyrazin-2-yl]-3-pyridinyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]acetonitrile;N-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]-2-pyridinyl]pyrazin-2-amine;6-methyl-5-[5-[1-[5-[1-(oxetan-3-yl)pyrazol-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 157454958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).