[5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine

C101H96BBr7F2I2N22O12Si — CID 159411778

About [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine

[5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine (PubChem CID 159411778) has the molecular formula C101H96BBr7F2I2N22O12Si and a molecular weight of 2700.05 g/mol. Its IUPAC name is [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine.

Molecular Properties

• Compound Name: [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine
• PubChem CID: 159411778
• Molecular Formula: C101H96BBr7F2I2N22O12Si
• Molecular Weight: 2700.05 g/mol
• Exact Mass: 2691.98
• IUPAC Name: [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine
• SMILES: Brc1cnc2[nH]ncc2c1.Brc1cnc2n[nH]c(I)c2c1.COc1ccccc1-c1[nH]nc2ncc(-c3ccc(O)c(C(=O)N4CCOCC4)c3)cc12.COc1ccccc1C1=NCc2ncc(B3OC(C)(C)C(C)(C)O3)cc21.COc1ccccc1C1=NCc2ncc(Br)cc21.C[Si](C)(C)CCOCn1nc(I)c2cc(Br)cnc21.Fc1ccc(Br)cn1.NNc1ncc(Br)cc1C1OCCO1.O=Cc1cc(Br)cnc1F
• InChI: InChI=1S/C24H22N4O4.C20H23BN2O3.C14H11BrN2O.C12H17BrIN3OSi.C8H10BrN3O2.C6H3BrFNO.C6H3BrIN3.C6H4BrN3.C5H3BrFN/c1-31-21-5-3-2-4-17(21)22-19-13-16(14-25-23(19)27-26-22)15-6-7-20(29)18(12-15)24(30)28-8-10-32-11-9-28;1-19(2)20(3,4)26-21(25-19)13-10-15-16(22-11-13)12-23-18(15)14-8-6-7-9-17(14)24-5;1-18-13-5-3-2-4-10(13)14-11-6-9(15)7-16-12(11)8-17-14;1-19(2,3)5-4-18-8-17-12-10(11(14)16-17)6-9(13)7-15-12;9-5-3-6(7(12-10)11-4-5)8-13-1-2-14-8;7-5-1-4(3-10)6(8)9-2-5;7-3-1-4-5(8)10-11-6(4)9-2-3;7-5-1-4-2-9-10-6(4)8-3-5;6-4-1-2-5(7)8-3-4/h2-7,12-14,29H,8-11H2,1H3,(H,25,26,27);6-11H,12H2,1-5H3;2-7H,8H2,1H3;6-7H,4-5,8H2,1-3H3;3-4,8H,1-2,10H2,(H,11,12);1-3H;1-2H,(H,9,10,11);1-3H,(H,8,9,10);1-3H
• InChIKey: LOQXZGREEUZVRB-UHFFFAOYSA-N
• XLogP: 22.53
• TPSA: 423.32 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 17
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2700.05
LogP ≤ 5	22.53
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine?

The IUPAC name of [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine (CID 159411778) is [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine.

What is the SMILES notation for [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine?

The canonical SMILES for [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine is Brc1cnc2[nH]ncc2c1.Brc1cnc2n[nH]c(I)c2c1.COc1ccccc1-c1[nH]nc2ncc(-c3ccc(O)c(C(=O)N4CCOCC4)c3)cc12.COc1ccccc1C1=NCc2ncc(B3OC(C)(C)C(C)(C)O3)cc21.COc1ccccc1C1=NCc2ncc(Br)cc21.C[Si](C)(C)CCOCn1nc(I)c2cc(Br)cnc21.Fc1ccc(Br)cn1.NNc1ncc(Br)cc1C1OCCO1.O=Cc1cc(Br)cnc1F.

What is the InChIKey of [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine?

The InChIKey is LOQXZGREEUZVRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O4.C20H23BN2O3.C14H11BrN2O.C12H17BrIN3OSi.C8H10BrN3O2.C6H3BrFNO.C6H3BrIN3.C6H4BrN3.C5H3BrFN/c1-31-21-5-3-2-4-17(21)22-19-13-16(14-25-23(19)27-26-22)15-6-7-20(29)18(12-15)24(30)28-8-10-32-11-9-28;1-19(2)20(3,4)26-21(25-19)13-10-15-16(22-11-13)12-23-18(15)14-8-6-7-9-17(14)24-5;1-18-13-5-3-2-4-10(13)14-11-6-9(15)7-16-12(11)8-17-14;1-19(2,3)5-4-18-8-17-12-10(11(14)16-17)6-9(13)7-15-12;9-5-3-6(7(12-10)11-4-5)8-13-1-2-14-8;7-5-1-4(3-10)6(8)9-2-5;7-3-1-4-5(8)10-11-6(4)9-2-3;7-5-1-4-2-9-10-6(4)8-3-5;6-4-1-2-5(7)8-3-4/h2-7,12-14,29H,8-11H2,1H3,(H,25,26,27);6-11H,12H2,1-5H3;2-7H,8H2,1H3;6-7H,4-5,8H2,1-3H3;3-4,8H,1-2,10H2,(H,11,12);1-3H;1-2H,(H,9,10,11);1-3H,(H,8,9,10);1-3H.

What are the key properties of [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine?

[5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine has a molecular weight of 2700.05 g/mol, XLogP of 22.53, 17 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for [5-bromo-3-(1,3-dioxolan-2-yl)-2-pyridinyl]hydrazine;5-bromo-2-fluoropyridine;5-bromo-2-fluoropyridine-3-carbaldehyde;5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine;2-[(5-bromo-3-iodopyrazolo[5,4-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;3-bromo-5-(2-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridine;5-bromo-1H-pyrazolo[3,4-b]pyridine;[2-hydroxy-5-[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-5-yl]phenyl]-morpholin-4-ylmethanone;5-(2-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[3,4-b]pyridine is sourced from PubChem (CID 159411778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).