1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine

C134H147N27O6 — CID 160960169

About 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine

1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 160960169) has the molecular formula C134H147N27O6 and a molecular weight of 2231.83 g/mol. Its IUPAC name is 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

• Compound Name: 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine
• PubChem CID: 160960169
• Molecular Formula: C134H147N27O6
• Molecular Weight: 2231.83 g/mol
• Exact Mass: 2230.20
• IUPAC Name: 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine
• SMILES: CC(=O)C1(c2nnc3c(C(C)(C)O)cccn23)CC1.Cc1ccc(-c2ccc(C(C)(C)c3nnc4c(C(C)(C)C(=O)O)cccn34)cc2)cc1.Cc1ccc(-c2ccc(C(C)(C)c3nnc4c(C(C)(C)CO)cccn34)cc2)cc1.Cc1ccc(-c2ccc(C(C)(C)c3nnc4c(C(C)(C)c5nn[nH]n5)cccn34)cc2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)CC(N)=O)cccn34)CC2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)Cc5nn[nH]n5)cccn34)CC2)cc1
• InChI: InChI=1S/C26H27N7.C26H27N3O2.C26H29N3O.C21H23N7.C21H24N4O.C14H17N3O2/c1-17-8-10-18(11-9-17)19-12-14-20(15-13-19)25(2,3)24-30-27-22-21(7-6-16-33(22)24)26(4,5)23-28-31-32-29-23;1-17-8-10-18(11-9-17)19-12-14-20(15-13-19)25(2,3)23-28-27-22-21(7-6-16-29(22)23)26(4,5)24(30)31;1-18-8-10-19(11-9-18)20-12-14-21(15-13-20)26(4,5)24-28-27-23-22(25(2,3)17-30)7-6-16-29(23)24;1-14-6-8-15(9-7-14)21(10-11-21)19-25-24-18-16(5-4-12-28(18)19)20(2,3)13-17-22-26-27-23-17;1-14-6-8-15(9-7-14)21(10-11-21)19-24-23-18-16(5-4-12-25(18)19)20(2,3)13-17(22)26;1-9(18)14(6-7-14)12-16-15-11-10(13(2,3)19)5-4-8-17(11)12/h6-16H,1-5H3,(H,28,29,31,32);6-16H,1-5H3,(H,30,31);6-16,30H,17H2,1-5H3;4-9,12H,10-11,13H2,1-3H3,(H,22,23,26,27);4-9,12H,10-11,13H2,1-3H3,(H2,22,26);4-5,8,19H,6-7H2,1-3H3
• InChIKey: SWXIJBMUKLQHMH-UHFFFAOYSA-N
• XLogP: 23.56
• TPSA: 427.98 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 29
• Rotatable Bonds: 28
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2231.83
LogP ≤ 5	23.56
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine?

The IUPAC name of 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine (CID 160960169) is 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine.

What is the SMILES notation for 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine?

The canonical SMILES for 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine is CC(=O)C1(c2nnc3c(C(C)(C)O)cccn23)CC1.Cc1ccc(-c2ccc(C(C)(C)c3nnc4c(C(C)(C)C(=O)O)cccn34)cc2)cc1.Cc1ccc(-c2ccc(C(C)(C)c3nnc4c(C(C)(C)CO)cccn34)cc2)cc1.Cc1ccc(-c2ccc(C(C)(C)c3nnc4c(C(C)(C)c5nn[nH]n5)cccn34)cc2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)CC(N)=O)cccn34)CC2)cc1.Cc1ccc(C2(c3nnc4c(C(C)(C)Cc5nn[nH]n5)cccn34)CC2)cc1.

What is the InChIKey of 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine?

The InChIKey is SWXIJBMUKLQHMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N7.C26H27N3O2.C26H29N3O.C21H23N7.C21H24N4O.C14H17N3O2/c1-17-8-10-18(11-9-17)19-12-14-20(15-13-19)25(2,3)24-30-27-22-21(7-6-16-33(22)24)26(4,5)23-28-31-32-29-23;1-17-8-10-18(11-9-17)19-12-14-20(15-13-19)25(2,3)23-28-27-22-21(7-6-16-29(22)23)26(4,5)24(30)31;1-18-8-10-19(11-9-18)20-12-14-21(15-13-20)26(4,5)24-28-27-23-22(25(2,3)17-30)7-6-16-29(23)24;1-14-6-8-15(9-7-14)21(10-11-21)19-25-24-18-16(5-4-12-28(18)19)20(2,3)13-17-22-26-27-23-17;1-14-6-8-15(9-7-14)21(10-11-21)19-24-23-18-16(5-4-12-25(18)19)20(2,3)13-17(22)26;1-9(18)14(6-7-14)12-16-15-11-10(13(2,3)19)5-4-8-17(11)12/h6-16H,1-5H3,(H,28,29,31,32);6-16H,1-5H3,(H,30,31);6-16,30H,17H2,1-5H3;4-9,12H,10-11,13H2,1-3H3,(H,22,23,26,27);4-9,12H,10-11,13H2,1-3H3,(H2,22,26);4-5,8,19H,6-7H2,1-3H3.

What are the key properties of 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine?

1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 2231.83 g/mol, XLogP of 23.56, 28 rotatable bonds, 6 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[1-[8-(2-hydroxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]cyclopropyl]ethanone;3-methyl-3-[3-[1-(4-methylphenyl)cyclopropyl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]butanamide;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propanoic acid;2-methyl-2-[3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridin-8-yl]propan-1-ol;3-[1-(4-methylphenyl)cyclopropyl]-8-[2-methyl-1-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine;3-[2-[4-(4-methylphenyl)phenyl]propan-2-yl]-8-[2-(2H-tetrazol-5-yl)propan-2-yl]-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 160960169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).