5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole

C128H124N26O10 — CID 162265959

About 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole

5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole (PubChem CID 162265959) has the molecular formula C128H124N26O10 and a molecular weight of 2186.57 g/mol. Its IUPAC name is 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole.

Molecular Properties

• Compound Name: 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole
• PubChem CID: 162265959
• Molecular Formula: C128H124N26O10
• Molecular Weight: 2186.57 g/mol
• Exact Mass: 2185.00
• IUPAC Name: 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole
• SMILES: CC(C)(C)c1cc(-c2nc(-c3ccncc3)no2)cc(C(C)(C)C)c1.CCOc1ccc(-c2nc(-c3cncc(C)c3)no2)cc1OCC.CCn1nc(C)cc1-c1nc(-c2ccncc2)no1.Cc1ccc(-c2nc(-c3cccnc3)no2)cc1C.Cc1ccc(-c2nc(-c3ccncc3C)no2)cc1C.Cc1ccc(-c2nc(-c3ccncc3C)no2)cc1C.Cc1cccc(-c2nc(-c3cccnc3)no2)c1.Cc1cncc(-c2noc(-c3cccc(C)c3)n2)c1
• InChI: InChI=1S/C21H25N3O.C18H19N3O3.2C16H15N3O.2C15H13N3O.C14H11N3O.C13H13N5O/c1-20(2,3)16-11-15(12-17(13-16)21(4,5)6)19-23-18(24-25-19)14-7-9-22-10-8-14;1-4-22-15-7-6-13(9-16(15)23-5-2)18-20-17(21-24-18)14-8-12(3)10-19-11-14;2*1-10-4-5-13(8-11(10)2)16-18-15(19-20-16)14-6-7-17-9-12(14)3;1-10-5-6-12(8-11(10)2)15-17-14(18-19-15)13-4-3-7-16-9-13;1-10-4-3-5-12(6-10)15-17-14(18-19-15)13-7-11(2)8-16-9-13;1-10-4-2-5-11(8-10)14-16-13(17-18-14)12-6-3-7-15-9-12;1-3-18-11(8-9(2)16-18)13-15-12(17-19-13)10-4-6-14-7-5-10/h7-13H,1-6H3;6-11H,4-5H2,1-3H3;2*4-9H,1-3H3;2*3-9H,1-2H3;2-9H,1H3;4-8H,3H2,1-2H3
• InChIKey: ZZXCBDFVDPQMCO-UHFFFAOYSA-N
• XLogP: 29.01
• TPSA: 450.76 Ų
• H-Bond Acceptors: 36
• Rotatable Bonds: 21
• Heavy Atoms: 164
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2186.57
LogP ≤ 5	29.01
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	36

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole?

The IUPAC name of 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole (CID 162265959) is 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole.

What is the SMILES notation for 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole?

The canonical SMILES for 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole is CC(C)(C)c1cc(-c2nc(-c3ccncc3)no2)cc(C(C)(C)C)c1.CCOc1ccc(-c2nc(-c3cncc(C)c3)no2)cc1OCC.CCn1nc(C)cc1-c1nc(-c2ccncc2)no1.Cc1ccc(-c2nc(-c3cccnc3)no2)cc1C.Cc1ccc(-c2nc(-c3ccncc3C)no2)cc1C.Cc1ccc(-c2nc(-c3ccncc3C)no2)cc1C.Cc1cccc(-c2nc(-c3cccnc3)no2)c1.Cc1cncc(-c2noc(-c3cccc(C)c3)n2)c1.

What is the InChIKey of 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole?

The InChIKey is ZZXCBDFVDPQMCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O.C18H19N3O3.2C16H15N3O.2C15H13N3O.C14H11N3O.C13H13N5O/c1-20(2,3)16-11-15(12-17(13-16)21(4,5)6)19-23-18(24-25-19)14-7-9-22-10-8-14;1-4-22-15-7-6-13(9-16(15)23-5-2)18-20-17(21-24-18)14-8-12(3)10-19-11-14;2*1-10-4-5-13(8-11(10)2)16-18-15(19-20-16)14-6-7-17-9-12(14)3;1-10-5-6-12(8-11(10)2)15-17-14(18-19-15)13-4-3-7-16-9-13;1-10-4-3-5-12(6-10)15-17-14(18-19-15)13-7-11(2)8-16-9-13;1-10-4-2-5-11(8-10)14-16-13(17-18-14)12-6-3-7-15-9-12;1-3-18-11(8-9(2)16-18)13-15-12(17-19-13)10-4-6-14-7-5-10/h7-13H,1-6H3;6-11H,4-5H2,1-3H3;2*4-9H,1-3H3;2*3-9H,1-2H3;2-9H,1H3;4-8H,3H2,1-2H3.

What are the key properties of 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole?

5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole has a molecular weight of 2186.57 g/mol, XLogP of 29.01, 21 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3,5-ditert-butylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole);5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole;5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;5-(3-methylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole is sourced from PubChem (CID 162265959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).