5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole

C125H116F3N21O8S — CID 158931030

About 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole

5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole (PubChem CID 158931030) has the molecular formula C125H116F3N21O8S and a molecular weight of 2129.50 g/mol. Its IUPAC name is 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole.

Molecular Properties

• Compound Name: 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole
• PubChem CID: 158931030
• Molecular Formula: C125H116F3N21O8S
• Molecular Weight: 2129.50 g/mol
• Exact Mass: 2127.90
• IUPAC Name: 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole
• SMILES: CC(C)Cc1cccc(-c2nc(-c3ccncc3)no2)c1.CCC1CCC(c2nc(-c3ccncc3)no2)CC1.CCCCC1CCC(c2nc(-c3ccncc3)no2)CC1.Cc1sc(-c2nc(-c3ccncc3)no2)cc1-c1ccccc1.FC(F)(F)c1cc(-c2ccccc2)cc(-c2nc(-c3ccncc3)no2)c1.c1ccc(C2CCC(c3nc(-c4ccncc4)no3)CC2)cc1.c1ccc(Oc2cccc(-c3nc(-c4ccncc4)no3)c2)cc1
• InChI: InChI=1S/C20H12F3N3O.C19H13N3O2.C19H19N3O.C18H13N3OS.C17H17N3O.C17H23N3O.C15H19N3O/c21-20(22,23)17-11-15(13-4-2-1-3-5-13)10-16(12-17)19-25-18(26-27-19)14-6-8-24-9-7-14;1-2-6-16(7-3-1)23-17-8-4-5-15(13-17)19-21-18(22-24-19)14-9-11-20-12-10-14;1-2-4-14(5-3-1)15-6-8-17(9-7-15)19-21-18(22-23-19)16-10-12-20-13-11-16;1-12-15(13-5-3-2-4-6-13)11-16(23-12)18-20-17(21-22-18)14-7-9-19-10-8-14;1-12(2)10-13-4-3-5-15(11-13)17-19-16(20-21-17)14-6-8-18-9-7-14;1-2-3-4-13-5-7-15(8-6-13)17-19-16(20-21-17)14-9-11-18-12-10-14;1-2-11-3-5-13(6-4-11)15-17-14(18-19-15)12-7-9-16-10-8-12/h1-12H;1-13H;1-5,10-13,15,17H,6-9H2;2-11H,1H3;3-9,11-12H,10H2,1-2H3;9-13,15H,2-8H2,1H3;7-11,13H,2-6H2,1H3
• InChIKey: JJBCACUNUFYFAF-UHFFFAOYSA-N
• XLogP: 31.89
• TPSA: 371.90 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 25
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2129.50
LogP ≤ 5	31.89
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole?

The IUPAC name of 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole (CID 158931030) is 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole.

What is the SMILES notation for 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole?

The canonical SMILES for 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole is CC(C)Cc1cccc(-c2nc(-c3ccncc3)no2)c1.CCC1CCC(c2nc(-c3ccncc3)no2)CC1.CCCCC1CCC(c2nc(-c3ccncc3)no2)CC1.Cc1sc(-c2nc(-c3ccncc3)no2)cc1-c1ccccc1.FC(F)(F)c1cc(-c2ccccc2)cc(-c2nc(-c3ccncc3)no2)c1.c1ccc(C2CCC(c3nc(-c4ccncc4)no3)CC2)cc1.c1ccc(Oc2cccc(-c3nc(-c4ccncc4)no3)c2)cc1.

What is the InChIKey of 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole?

The InChIKey is JJBCACUNUFYFAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12F3N3O.C19H13N3O2.C19H19N3O.C18H13N3OS.C17H17N3O.C17H23N3O.C15H19N3O/c21-20(22,23)17-11-15(13-4-2-1-3-5-13)10-16(12-17)19-25-18(26-27-19)14-6-8-24-9-7-14;1-2-6-16(7-3-1)23-17-8-4-5-15(13-17)19-21-18(22-24-19)14-9-11-20-12-10-14;1-2-4-14(5-3-1)15-6-8-17(9-7-15)19-21-18(22-23-19)16-10-12-20-13-11-16;1-12-15(13-5-3-2-4-6-13)11-16(23-12)18-20-17(21-22-18)14-7-9-19-10-8-14;1-12(2)10-13-4-3-5-15(11-13)17-19-16(20-21-17)14-6-8-18-9-7-14;1-2-3-4-13-5-7-15(8-6-13)17-19-16(20-21-17)14-9-11-18-12-10-14;1-2-11-3-5-13(6-4-11)15-17-14(18-19-15)12-7-9-16-10-8-12/h1-12H;1-13H;1-5,10-13,15,17H,6-9H2;2-11H,1H3;3-9,11-12H,10H2,1-2H3;9-13,15H,2-8H2,1H3;7-11,13H,2-6H2,1H3.

What are the key properties of 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole?

5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole has a molecular weight of 2129.50 g/mol, XLogP of 31.89, 25 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(4-butylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(5-methyl-4-phenylthiophen-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-(2-methylpropyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-phenylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-[3-phenyl-5-(trifluoromethyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole is sourced from PubChem (CID 158931030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).