8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline

C103H87B2ClF10N14O9 — CID 161359739

About 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline

8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline (PubChem CID 161359739) has the molecular formula C103H87B2ClF10N14O9 and a molecular weight of 1928.07 g/mol. Its IUPAC name is 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline.

Molecular Properties

• Compound Name: 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline
• PubChem CID: 161359739
• Molecular Formula: C103H87B2ClF10N14O9
• Molecular Weight: 1928.07 g/mol
• Exact Mass: 1926.75
• IUPAC Name: 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline
• SMILES: Cc1ncc(B2OC(C)(C)C(C)(C)O2)cc1C(=O)O.Fc1cccc(-c2ncc3c(Cl)cccn23)c1F.[2H]c1c([2H])c(F)c([2H])c([2H])c1N.[2H]c1c([2H])c(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C)c([2H])c([2H])c1F.[2H]c1c([2H])c(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C)c([2H])c([2H])c1F.[2H]c1c([2H])c(NC(=O)c2cc(B3OC(C)(C)C(C)(C)O3)cnc2C)c([2H])c([2H])c1F
• InChI: InChI=1S/2C26H17F3N4O.C19H22BFN2O3.C13H18BNO4.C13H7ClF2N2.C6H6FN/c2*1-15-21(26(34)32-18-9-7-17(27)8-10-18)12-16(13-30-15)19-5-3-11-33-23(19)14-31-25(33)20-4-2-6-22(28)24(20)29;1-12-16(17(24)23-15-8-6-14(21)7-9-15)10-13(11-22-12)20-25-18(2,3)19(4,5)26-20;1-8-10(11(16)17)6-9(7-15-8)14-18-12(2,3)13(4,5)19-14;14-9-4-2-6-18-11(9)7-17-13(18)8-3-1-5-10(15)12(8)16;7-5-1-3-6(8)4-2-5/h2*2-14H,1H3,(H,32,34);6-11H,1-5H3,(H,23,24);6-7H,1-5H3,(H,16,17);1-7H;1-4H,8H2/i2*7D,8D,9D,10D;6D,7D,8D,9D;;;1D,2D,3D,4D
• InChIKey: VPABUAKZARBUSY-SOZVBYRUSA-N
• XLogP: 21.89
• TPSA: 291.00 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 19
• Rotatable Bonds: 14
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1928.07
LogP ≤ 5	21.89
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline?

The IUPAC name of 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline (CID 161359739) is 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline.

What is the SMILES notation for 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline?

The canonical SMILES for 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline is Cc1ncc(B2OC(C)(C)C(C)(C)O2)cc1C(=O)O.Fc1cccc(-c2ncc3c(Cl)cccn23)c1F.[2H]c1c([2H])c(F)c([2H])c([2H])c1N.[2H]c1c([2H])c(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C)c([2H])c([2H])c1F.[2H]c1c([2H])c(NC(=O)c2cc(-c3cccn4c(-c5cccc(F)c5F)ncc34)cnc2C)c([2H])c([2H])c1F.[2H]c1c([2H])c(NC(=O)c2cc(B3OC(C)(C)C(C)(C)O3)cnc2C)c([2H])c([2H])c1F.

What is the InChIKey of 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline?

The InChIKey is VPABUAKZARBUSY-SOZVBYRUSA-N. The full InChI is InChI=1S/2C26H17F3N4O.C19H22BFN2O3.C13H18BNO4.C13H7ClF2N2.C6H6FN/c2*1-15-21(26(34)32-18-9-7-17(27)8-10-18)12-16(13-30-15)19-5-3-11-33-23(19)14-31-25(33)20-4-2-6-22(28)24(20)29;1-12-16(17(24)23-15-8-6-14(21)7-9-15)10-13(11-22-12)20-25-18(2,3)19(4,5)26-20;1-8-10(11(16)17)6-9(7-15-8)14-18-12(2,3)13(4,5)19-14;14-9-4-2-6-18-11(9)7-17-13(18)8-3-1-5-10(15)12(8)16;7-5-1-3-6(8)4-2-5/h2*2-14H,1H3,(H,32,34);6-11H,1-5H3,(H,23,24);6-7H,1-5H3,(H,16,17);1-7H;1-4H,8H2/i2*7D,8D,9D,10D;6D,7D,8D,9D;;;1D,2D,3D,4D.

What are the key properties of 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline?

8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline has a molecular weight of 1928.07 g/mol, XLogP of 21.89, 14 rotatable bonds, 5 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 8-chloro-3-(2,3-difluorophenyl)imidazo[1,5-a]pyridine;bis(5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)pyridine-3-carboxamide);2-methyl-N-(2,3,5,6-tetradeuterio-4-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxamide;2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylic acid;2,3,5,6-tetradeuterio-4-fluoroaniline is sourced from PubChem (CID 161359739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).