4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline

C121H99N21O5 — CID 157265084

About 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline

4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline (PubChem CID 157265084) has the molecular formula C121H99N21O5 and a molecular weight of 1927.26 g/mol. Its IUPAC name is 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline.

Molecular Properties

• Compound Name: 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline
• PubChem CID: 157265084
• Molecular Formula: C121H99N21O5
• Molecular Weight: 1927.26 g/mol
• Exact Mass: 1925.81
• IUPAC Name: 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline
• SMILES: C=CCOc1ccc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)cc1.CC(C)Oc1ccc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)cc1.CCC(C)Oc1ccc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)cc1.CCOc1ccc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)cc1.O=c1cc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)ccn1C1CCCC1
• InChI: InChI=1S/C25H21N5O.C25H22N4O.C24H20N4O.C24H18N4O.C23H18N4O/c31-24-16-18(10-13-29(24)19-5-1-2-6-19)17-11-14-30-23(15-17)27-28-25(30)21-9-12-26-22-8-4-3-7-20(21)22;1-3-17(2)30-20-10-8-18(9-11-20)19-13-15-29-24(16-19)27-28-25(29)22-12-14-26-23-7-5-4-6-21(22)23;1-16(2)29-19-9-7-17(8-10-19)18-12-14-28-23(15-18)26-27-24(28)21-11-13-25-22-6-4-3-5-20(21)22;1-2-15-29-19-9-7-17(8-10-19)18-12-14-28-23(16-18)26-27-24(28)21-11-13-25-22-6-4-3-5-20(21)22;1-2-28-18-9-7-16(8-10-18)17-12-14-27-22(15-17)25-26-23(27)20-11-13-24-21-6-4-3-5-19(20)21/h3-4,7-16,19H,1-2,5-6H2;4-17H,3H2,1-2H3;3-16H,1-2H3;2-14,16H,1,15H2;3-15H,2H2,1H3
• InChIKey: AXXCFIJQSDJGFF-UHFFFAOYSA-N
• XLogP: 26.26
• TPSA: 274.32 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 21
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1927.26
LogP ≤ 5	26.26
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline?

The IUPAC name of 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline (CID 157265084) is 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline.

What is the SMILES notation for 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline?

The canonical SMILES for 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline is C=CCOc1ccc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)cc1.CC(C)Oc1ccc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)cc1.CCC(C)Oc1ccc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)cc1.CCOc1ccc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)cc1.O=c1cc(-c2ccn3c(-c4ccnc5ccccc45)nnc3c2)ccn1C1CCCC1.

What is the InChIKey of 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline?

The InChIKey is AXXCFIJQSDJGFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N5O.C25H22N4O.C24H20N4O.C24H18N4O.C23H18N4O/c31-24-16-18(10-13-29(24)19-5-1-2-6-19)17-11-14-30-23(15-17)27-28-25(30)21-9-12-26-22-8-4-3-7-20(21)22;1-3-17(2)30-20-10-8-18(9-11-20)19-13-15-29-24(16-19)27-28-25(29)22-12-14-26-23-7-5-4-6-21(22)23;1-16(2)29-19-9-7-17(8-10-19)18-12-14-28-23(15-18)26-27-24(28)21-11-13-25-22-6-4-3-5-20(21)22;1-2-15-29-19-9-7-17(8-10-19)18-12-14-28-23(16-18)26-27-24(28)21-11-13-25-22-6-4-3-5-20(21)22;1-2-28-18-9-7-16(8-10-18)17-12-14-27-22(15-17)25-26-23(27)20-11-13-24-21-6-4-3-5-19(20)21/h3-4,7-16,19H,1-2,5-6H2;4-17H,3H2,1-2H3;3-16H,1-2H3;2-14,16H,1,15H2;3-15H,2H2,1H3.

What are the key properties of 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline?

4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline has a molecular weight of 1927.26 g/mol, XLogP of 26.26, 21 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[7-(4-butan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;1-cyclopentyl-4-(3-quinolin-4-yl-[1,2,4]triazolo[4,3-a]pyridin-7-yl)pyridin-2-one;4-[7-(4-ethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-propan-2-yloxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline;4-[7-(4-prop-2-enoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline is sourced from PubChem (CID 157265084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).