5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole

C103H96N18O11 — CID 158733609

About 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole

5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole (PubChem CID 158733609) has the molecular formula C103H96N18O11 and a molecular weight of 1762.02 g/mol. Its IUPAC name is 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole.

Molecular Properties

• Compound Name: 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole
• PubChem CID: 158733609
• Molecular Formula: C103H96N18O11
• Molecular Weight: 1762.02 g/mol
• Exact Mass: 1760.75
• IUPAC Name: 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole
• SMILES: CCC1CCC(c2nc(-c3ccncc3)no2)CC1.CCOc1cc(OCC)cc(-c2nc(-c3ccncc3)no2)c1.CCOc1ccc(-c2nc(-c3cccc4[nH]ccc34)no2)cc1OCC.Cc1cc(-c2ccccc2)cc(-c2nc(-c3ccncc3)no2)c1.c1cc(-c2noc(C3CCCC3)n2)ccn1.c1ccc(Oc2cccc(-c3nc(-c4ccncc4)no3)c2)cc1
• InChI: InChI=1S/C20H19N3O3.C20H15N3O.C19H13N3O2.C17H17N3O3.C15H19N3O.C12H13N3O/c1-3-24-17-9-8-13(12-18(17)25-4-2)20-22-19(23-26-20)15-6-5-7-16-14(15)10-11-21-16;1-14-11-17(15-5-3-2-4-6-15)13-18(12-14)20-22-19(23-24-20)16-7-9-21-10-8-16;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;1-3-21-14-9-13(10-15(11-14)22-4-2)17-19-16(20-23-17)12-5-7-18-8-6-12;1-2-11-3-5-13(6-4-11)15-17-14(18-19-15)12-7-9-16-10-8-12;1-2-4-10(3-1)12-14-11(15-16-12)9-5-7-13-8-6-9/h5-12,21H,3-4H2,1-2H3;2-13H,1H3;1-13H;5-11H,3-4H2,1-2H3;7-11,13H,2-6H2,1H3;5-8,10H,1-4H2
• InChIKey: ILKADAXZOBFXDN-UHFFFAOYSA-N
• XLogP: 24.25
• TPSA: 359.91 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 28
• Rotatable Bonds: 24
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1762.02
LogP ≤ 5	24.25
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole?

The IUPAC name of 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole (CID 158733609) is 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole.

What is the SMILES notation for 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole?

The canonical SMILES for 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole is CCC1CCC(c2nc(-c3ccncc3)no2)CC1.CCOc1cc(OCC)cc(-c2nc(-c3ccncc3)no2)c1.CCOc1ccc(-c2nc(-c3cccc4[nH]ccc34)no2)cc1OCC.Cc1cc(-c2ccccc2)cc(-c2nc(-c3ccncc3)no2)c1.c1cc(-c2noc(C3CCCC3)n2)ccn1.c1ccc(Oc2cccc(-c3nc(-c4ccncc4)no3)c2)cc1.

What is the InChIKey of 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole?

The InChIKey is ILKADAXZOBFXDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3.C20H15N3O.C19H13N3O2.C17H17N3O3.C15H19N3O.C12H13N3O/c1-3-24-17-9-8-13(12-18(17)25-4-2)20-22-19(23-26-20)15-6-5-7-16-14(15)10-11-21-16;1-14-11-17(15-5-3-2-4-6-15)13-18(12-14)20-22-19(23-24-20)16-7-9-21-10-8-16;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;1-3-21-14-9-13(10-15(11-14)22-4-2)17-19-16(20-23-17)12-5-7-18-8-6-12;1-2-11-3-5-13(6-4-11)15-17-14(18-19-15)12-7-9-16-10-8-12;1-2-4-10(3-1)12-14-11(15-16-12)9-5-7-13-8-6-9/h5-12,21H,3-4H2,1-2H3;2-13H,1H3;1-13H;5-11H,3-4H2,1-2H3;7-11,13H,2-6H2,1H3;5-8,10H,1-4H2.

What are the key properties of 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole?

5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole has a molecular weight of 1762.02 g/mol, XLogP of 24.25, 24 rotatable bonds, 1 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 5-cyclopentyl-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3,4-diethoxyphenyl)-3-(1H-indol-4-yl)-1,2,4-oxadiazole;5-(3,5-diethoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(4-ethylcyclohexyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-methyl-5-phenylphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole;5-(3-phenoxyphenyl)-3-pyridin-4-yl-1,2,4-oxadiazole is sourced from PubChem (CID 158733609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).