sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide

C84H72BBrN13NaO10 — CID 158929968

About sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide

sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide (PubChem CID 158929968) has the molecular formula C84H72BBrN13NaO10 and a molecular weight of 1537.29 g/mol. Its IUPAC name is sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide.

Molecular Properties

• Compound Name: sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide
• PubChem CID: 158929968
• Molecular Formula: C84H72BBrN13NaO10
• Molecular Weight: 1537.29 g/mol
• Exact Mass: 1535.47
• IUPAC Name: sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide
• SMILES: CCOC(=O)c1cnn2ccc(-c3ccccc3-c3cccc(C)n3)cc12.CCOC(=O)c1cnn2ccc(Br)cc12.Cc1cccc(-c2ccccc2-c2ccn3ncc(C(=O)O)c3c2)n1.Cc1cccc(-c2ccccc2-c2ccn3ncc(C(N)=O)c3c2)n1.Cc1cccc(-c2ccccc2B(O)O)n1.[Na+].[OH-]
• InChI: InChI=1S/C22H19N3O2.C20H16N4O.C20H15N3O2.C12H12BNO2.C10H9BrN2O2.Na.H2O/c1-3-27-22(26)19-14-23-25-12-11-16(13-21(19)25)17-8-4-5-9-18(17)20-10-6-7-15(2)24-20;1-13-5-4-8-18(23-13)16-7-3-2-6-15(16)14-9-10-24-19(11-14)17(12-22-24)20(21)25;1-13-5-4-8-18(22-13)16-7-3-2-6-15(16)14-9-10-23-19(11-14)17(12-21-23)20(24)25;1-9-5-4-8-12(14-9)10-6-2-3-7-11(10)13(15)16;1-2-15-10(14)8-6-12-13-4-3-7(11)5-9(8)13;;/h4-14H,3H2,1-2H3;2-12H,1H3,(H2,21,25);2-12H,1H3,(H,24,25);2-8,15-16H,1H3;3-6H,2H2,1H3;;1H2/q;;;;;+1;/p-1
• InChIKey: JIXSZNFAQSMFEQ-UHFFFAOYSA-M
• XLogP: 11.93
• TPSA: 324.21 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Rotatable Bonds: 14
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1537.29
LogP ≤ 5	11.93
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide?

The IUPAC name of sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide (CID 158929968) is sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide.

What is the SMILES notation for sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide?

The canonical SMILES for sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide is CCOC(=O)c1cnn2ccc(-c3ccccc3-c3cccc(C)n3)cc12.CCOC(=O)c1cnn2ccc(Br)cc12.Cc1cccc(-c2ccccc2-c2ccn3ncc(C(=O)O)c3c2)n1.Cc1cccc(-c2ccccc2-c2ccn3ncc(C(N)=O)c3c2)n1.Cc1cccc(-c2ccccc2B(O)O)n1.[Na+].[OH-].

What is the InChIKey of sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide?

The InChIKey is JIXSZNFAQSMFEQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C22H19N3O2.C20H16N4O.C20H15N3O2.C12H12BNO2.C10H9BrN2O2.Na.H2O/c1-3-27-22(26)19-14-23-25-12-11-16(13-21(19)25)17-8-4-5-9-18(17)20-10-6-7-15(2)24-20;1-13-5-4-8-18(23-13)16-7-3-2-6-15(16)14-9-10-24-19(11-14)17(12-22-24)20(21)25;1-13-5-4-8-18(22-13)16-7-3-2-6-15(16)14-9-10-23-19(11-14)17(12-21-23)20(24)25;1-9-5-4-8-12(14-9)10-6-2-3-7-11(10)13(15)16;1-2-15-10(14)8-6-12-13-4-3-7(11)5-9(8)13;;/h4-14H,3H2,1-2H3;2-12H,1H3,(H2,21,25);2-12H,1H3,(H,24,25);2-8,15-16H,1H3;3-6H,2H2,1H3;;1H2/q;;;;;+1;/p-1.

What are the key properties of sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide?

sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide has a molecular weight of 1537.29 g/mol, XLogP of 11.93, 14 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for sodium;ethyl 5-bromopyrazolo[1,5-a]pyridine-3-carboxylate;ethyl 5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylate;[2-(6-methyl-2-pyridinyl)phenyl]boronic acid;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid;hydroxide is sourced from PubChem (CID 158929968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).