2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine

C78H93Br2ClN28O4 — CID 157113538

About 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine

2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine (PubChem CID 157113538) has the molecular formula C78H93Br2ClN28O4 and a molecular weight of 1682.05 g/mol. Its IUPAC name is 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine.

Molecular Properties

• Compound Name: 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine
• PubChem CID: 157113538
• Molecular Formula: C78H93Br2ClN28O4
• Molecular Weight: 1682.05 g/mol
• Exact Mass: 1678.60
• IUPAC Name: 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine
• SMILES: CC(C)c1noc(-c2cc(Br)ccn2)n1.CC(C)c1noc(-c2cc(Cl)ccn2)n1.CC(C)c1noc(Cc2ccccn2)n1.CC(C)n1cc(-c2cccc(Br)n2)nn1.CC(C)n1cc(-c2ccccn2)nn1.CC(C)n1ccnn1.COc1cccc(-c2cn(C(C)C)nn2)n1.Cc1cccc(-c2cn(C(C)C)nn2)n1
• InChI: InChI=1S/C11H14N4O.C11H14N4.C11H13N3O.C10H11BrN4.C10H10BrN3O.C10H10ClN3O.C10H12N4.C5H9N3/c1-8(2)15-7-10(13-14-15)9-5-4-6-11(12-9)16-3;1-8(2)15-7-11(13-14-15)10-6-4-5-9(3)12-10;1-8(2)11-13-10(15-14-11)7-9-5-3-4-6-12-9;1-7(2)15-6-9(13-14-15)8-4-3-5-10(11)12-8;2*1-6(2)9-13-10(15-14-9)8-5-7(11)3-4-12-8;1-8(2)14-7-10(12-13-14)9-5-3-4-6-11-9;1-5(2)8-4-3-6-7-8/h4-8H,1-3H3;4-8H,1-3H3;3-6,8H,7H2,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3;3-8H,1-2H3;3-5H,1-2H3
• InChIKey: AHCXJWGVZMPHHE-UHFFFAOYSA-N
• XLogP: 17.73
• TPSA: 369.77 Ų
• H-Bond Acceptors: 32
• Rotatable Bonds: 17
• Heavy Atoms: 113
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1682.05
LogP ≤ 5	17.73
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine?

The IUPAC name of 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine (CID 157113538) is 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine.

What is the SMILES notation for 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine?

The canonical SMILES for 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine is CC(C)c1noc(-c2cc(Br)ccn2)n1.CC(C)c1noc(-c2cc(Cl)ccn2)n1.CC(C)c1noc(Cc2ccccn2)n1.CC(C)n1cc(-c2cccc(Br)n2)nn1.CC(C)n1cc(-c2ccccn2)nn1.CC(C)n1ccnn1.COc1cccc(-c2cn(C(C)C)nn2)n1.Cc1cccc(-c2cn(C(C)C)nn2)n1.

What is the InChIKey of 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine?

The InChIKey is AHCXJWGVZMPHHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O.C11H14N4.C11H13N3O.C10H11BrN4.C10H10BrN3O.C10H10ClN3O.C10H12N4.C5H9N3/c1-8(2)15-7-10(13-14-15)9-5-4-6-11(12-9)16-3;1-8(2)15-7-11(13-14-15)10-6-4-5-9(3)12-10;1-8(2)11-13-10(15-14-11)7-9-5-3-4-6-12-9;1-7(2)15-6-9(13-14-15)8-4-3-5-10(11)12-8;2*1-6(2)9-13-10(15-14-9)8-5-7(11)3-4-12-8;1-8(2)14-7-10(12-13-14)9-5-3-4-6-11-9;1-5(2)8-4-3-6-7-8/h4-8H,1-3H3;4-8H,1-3H3;3-6,8H,7H2,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3;3-8H,1-2H3;3-5H,1-2H3.

What are the key properties of 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine?

2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine has a molecular weight of 1682.05 g/mol, XLogP of 17.73, 17 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-6-(1-propan-2-yltriazol-4-yl)pyridine;5-(4-bromo-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;5-(4-chloro-2-pyridinyl)-3-propan-2-yl-1,2,4-oxadiazole;2-methoxy-6-(1-propan-2-yltriazol-4-yl)pyridine;2-methyl-6-(1-propan-2-yltriazol-4-yl)pyridine;3-propan-2-yl-5-(pyridin-2-ylmethyl)-1,2,4-oxadiazole;1-propan-2-yltriazole;2-(1-propan-2-yltriazol-4-yl)pyridine is sourced from PubChem (CID 157113538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).