5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol

C133H145F3N28O5 — CID 159575467

About 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol

5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol (PubChem CID 159575467) has the molecular formula C133H145F3N28O5 and a molecular weight of 2272.81 g/mol. Its IUPAC name is 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol.

Molecular Properties

• Compound Name: 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol
• PubChem CID: 159575467
• Molecular Formula: C133H145F3N28O5
• Molecular Weight: 2272.81 g/mol
• Exact Mass: 2271.19
• IUPAC Name: 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol
• SMILES: Cc1ccc(-c2noc(C34CCC(c5nnc6c(C(C)(C)O)cccn56)(CC3)CC4)n2)cc1.Cc1ccc(-c2noc(C34CCC(c5nnc6c(C7CC7)cccn56)(CC3)CC4)n2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)C(N)=O)cccn34)CCC2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)N)cccn34)CCC2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)c5nn[nH]n5)cccn34)CCC2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(O)C(F)(F)F)cccn34)CC2)cc1
• InChI: InChI=1S/C26H29N5O2.C26H27N5O.C21H23N7.C21H24N4O.C20H24N4.C19H18F3N3O/c1-17-6-8-18(9-7-17)20-27-23(33-30-20)26-13-10-25(11-14-26,12-15-26)22-29-28-21-19(24(2,3)32)5-4-16-31(21)22;1-17-4-6-19(7-5-17)21-27-24(32-30-21)26-13-10-25(11-14-26,12-15-26)23-29-28-22-20(18-8-9-18)3-2-16-31(22)23;1-14-7-9-15(10-8-14)21(11-5-12-21)19-25-22-17-16(6-4-13-28(17)19)20(2,3)18-23-26-27-24-18;1-14-7-9-15(10-8-14)21(11-5-12-21)19-24-23-17-16(6-4-13-25(17)19)20(2,3)18(22)26;1-14-7-9-15(10-8-14)20(11-5-12-20)18-23-22-17-16(19(2,3)21)6-4-13-24(17)18;1-12-5-7-13(8-6-12)18(9-10-18)16-24-23-15-14(4-3-11-25(15)16)17(2,26)19(20,21)22/h4-9,16,32H,10-15H2,1-3H3;2-7,16,18H,8-15H2,1H3;4,6-10,13H,5,11-12H2,1-3H3,(H,23,24,26,27);4,6-10,13H,5,11-12H2,1-3H3,(H2,22,26);4,6-10,13H,5,11-12,21H2,1-3H3;3-8,11,26H,9-10H2,1-2H3
• InChIKey: MIIUCGHCXULMLI-UHFFFAOYSA-N
• XLogP: 24.57
• TPSA: 423.01 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 31
• Rotatable Bonds: 22
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2272.81
LogP ≤ 5	24.57
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol?

The IUPAC name of 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol (CID 159575467) is 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol.

What is the SMILES notation for 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol?

The canonical SMILES for 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol is Cc1ccc(-c2noc(C34CCC(c5nnc6c(C(C)(C)O)cccn56)(CC3)CC4)n2)cc1.Cc1ccc(-c2noc(C34CCC(c5nnc6c(C7CC7)cccn56)(CC3)CC4)n2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)C(N)=O)cccn34)CCC2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)N)cccn34)CCC2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)c5nn[nH]n5)cccn34)CCC2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(O)C(F)(F)F)cccn34)CC2)cc1.

What is the InChIKey of 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol?

The InChIKey is MIIUCGHCXULMLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N5O2.C26H27N5O.C21H23N7.C21H24N4O.C20H24N4.C19H18F3N3O/c1-17-6-8-18(9-7-17)20-27-23(33-30-20)26-13-10-25(11-14-26,12-15-26)22-29-28-21-19(24(2,3)32)5-4-16-31(21)22;1-17-4-6-19(7-5-17)21-27-24(32-30-21)26-13-10-25(11-14-26,12-15-26)23-29-28-22-20(18-8-9-18)3-2-16-31(22)23;1-14-7-9-15(10-8-14)21(11-5-12-21)19-25-22-17-16(6-4-13-28(17)19)20(2,3)18-23-26-27-24-18;1-14-7-9-15(10-8-14)21(11-5-12-21)19-24-23-17-16(6-4-13-25(17)19)20(2,3)18(22)26;1-14-7-9-15(10-8-14)20(11-5-12-20)18-23-22-17-16(19(2,3)21)6-4-13-24(17)18;1-12-5-7-13(8-6-12)18(9-10-18)16-24-23-15-14(4-3-11-25(15)16)17(2,26)19(20,21)22/h4-9,16,32H,10-15H2,1-3H3;2-7,16,18H,8-15H2,1H3;4,6-10,13H,5,11-12H2,1-3H3,(H,23,24,26,27);4,6-10,13H,5,11-12H2,1-3H3,(H2,22,26);4,6-10,13H,5,11-12,21H2,1-3H3;3-8,11,26H,9-10H2,1-2H3.

What are the key properties of 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol?

5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol has a molecular weight of 2272.81 g/mol, XLogP of 24.57, 22 rotatable bonds, 5 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[4-(8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1-bicyclo[2.2.2]octanyl]-3-(4-methylphenyl)-1,2,4-oxadiazole;2-methyl-2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanamide;3-[1-(4-methylphenyl)cyclobutyl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;2-[3-[1-(4-methylphenyl)cyclobutyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-amine;2-[3-[4-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-bicyclo[2.2.2]octanyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol;1,1,1-trifluoro-2-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-2-ol is sourced from PubChem (CID 159575467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).