8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide

C86H62BBr3F16N10O7 — CID 159583300

About 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide

8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide (PubChem CID 159583300) has the molecular formula C86H62BBr3F16N10O7 and a molecular weight of 1902.00 g/mol. Its IUPAC name is 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide.

Molecular Properties

• Compound Name: 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide
• PubChem CID: 159583300
• Molecular Formula: C86H62BBr3F16N10O7
• Molecular Weight: 1902.00 g/mol
• Exact Mass: 1898.22
• IUPAC Name: 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide
• SMILES: CC1(C)OB(c2ccc(C(F)(F)F)c(C(=O)Nc3ccc(F)cc3)c2)OC1(C)C.Fc1cccc(-c2ncc3c(Br)cccn23)c1F.NCc1ncccc1Br.O=C(NCc1ncccc1Br)c1cccc(F)c1F.O=C(Nc1ccc(F)cc1)c1cc(-c2cccn3c(-c4cccc(F)c4F)ncc23)ccc1C(F)(F)F.O=C(O)c1cccc(F)c1F
• InChI: InChI=1S/C27H15F6N3O.C20H20BF4NO3.C13H9BrF2N2O.C13H7BrF2N2.C7H4F2O2.C6H7BrN2/c28-16-7-9-17(10-8-16)35-26(37)20-13-15(6-11-21(20)27(31,32)33)18-4-2-12-36-23(18)14-34-25(36)19-3-1-5-22(29)24(19)30;1-18(2)19(3,4)29-21(28-18)12-5-10-16(20(23,24)25)15(11-12)17(27)26-14-8-6-13(22)7-9-14;14-9-4-2-6-17-11(9)7-18-13(19)8-3-1-5-10(15)12(8)16;14-9-4-2-6-18-11(9)7-17-13(18)8-3-1-5-10(15)12(8)16;8-5-3-1-2-4(6(5)9)7(10)11;7-5-2-1-3-9-6(5)4-8/h1-14H,(H,35,37);5-11H,1-4H3,(H,26,27);1-6H,7H2,(H,18,19);1-7H;1-3H,(H,10,11);1-3H,4,8H2
• InChIKey: MJHFQONQVVJMBD-UHFFFAOYSA-N
• XLogP: 21.81
• TPSA: 229.46 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 13
• Rotatable Bonds: 13
• Heavy Atoms: 123
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1902.00
LogP ≤ 5	21.81
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide?

The IUPAC name of 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide (CID 159583300) is 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide.

What is the SMILES notation for 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide?

The canonical SMILES for 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide is CC1(C)OB(c2ccc(C(F)(F)F)c(C(=O)Nc3ccc(F)cc3)c2)OC1(C)C.Fc1cccc(-c2ncc3c(Br)cccn23)c1F.NCc1ncccc1Br.O=C(NCc1ncccc1Br)c1cccc(F)c1F.O=C(Nc1ccc(F)cc1)c1cc(-c2cccn3c(-c4cccc(F)c4F)ncc23)ccc1C(F)(F)F.O=C(O)c1cccc(F)c1F.

What is the InChIKey of 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide?

The InChIKey is MJHFQONQVVJMBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H15F6N3O.C20H20BF4NO3.C13H9BrF2N2O.C13H7BrF2N2.C7H4F2O2.C6H7BrN2/c28-16-7-9-17(10-8-16)35-26(37)20-13-15(6-11-21(20)27(31,32)33)18-4-2-12-36-23(18)14-34-25(36)19-3-1-5-22(29)24(19)30;1-18(2)19(3,4)29-21(28-18)12-5-10-16(20(23,24)25)15(11-12)17(27)26-14-8-6-13(22)7-9-14;14-9-4-2-6-17-11(9)7-18-13(19)8-3-1-5-10(15)12(8)16;14-9-4-2-6-18-11(9)7-17-13(18)8-3-1-5-10(15)12(8)16;8-5-3-1-2-4(6(5)9)7(10)11;7-5-2-1-3-9-6(5)4-8/h1-14H,(H,35,37);5-11H,1-4H3,(H,26,27);1-6H,7H2,(H,18,19);1-7H;1-3H,(H,10,11);1-3H,4,8H2.

What are the key properties of 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide?

8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide has a molecular weight of 1902.00 g/mol, XLogP of 21.81, 13 rotatable bonds, 5 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 8-bromo-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;(3-bromo-2-pyridinyl)methanamine;N-[(3-bromo-2-pyridinyl)methyl]-2,3-difluorobenzamide;2,3-difluorobenzoic acid;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-(trifluoromethyl)benzamide;N-(4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 159583300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).