acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine

C98H80B2Br4F8N16O14 — CID 159416166

About acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine

acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine (PubChem CID 159416166) has the molecular formula C98H80B2Br4F8N16O14 and a molecular weight of 2199.04 g/mol. Its IUPAC name is acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine.

Molecular Properties

• Compound Name: acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine
• PubChem CID: 159416166
• Molecular Formula: C98H80B2Br4F8N16O14
• Molecular Weight: 2199.04 g/mol
• Exact Mass: 2194.28
• IUPAC Name: acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine
• SMILES: BrBr.CC(=O)O.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)c(CO)nc23)cc1C(=O)Nc1ccc(F)cc1.Cc1ncc(-c2cccn3c(Br)c(CO)nc23)cc1C(=O)Nc1ccc(F)cc1.Cc1ncc(-c2cccn3cc(CO)nc23)cc1C(=O)Nc1ccc(F)cc1.Cc1ncc(B(O)O)cc1C(=O)Nc1ccc(F)cc1.OB(O)c1cccc(F)c1F.OCc1cn2cccc(Br)c2n1
• InChI: InChI=1S/C27H19F3N4O2.C21H16BrFN4O2.C21H17FN4O2.C13H12BFN2O3.C8H7BrN2O.C6H5BF2O2.C2H4O2.Br2/c1-15-21(27(36)32-18-9-7-17(28)8-10-18)12-16(13-31-15)19-5-3-11-34-25(23(14-35)33-26(19)34)20-4-2-6-22(29)24(20)30;1-12-17(21(29)25-15-6-4-14(23)5-7-15)9-13(10-24-12)16-3-2-8-27-19(22)18(11-28)26-20(16)27;1-13-19(21(28)25-16-6-4-15(22)5-7-16)9-14(10-23-13)18-3-2-8-26-11-17(12-27)24-20(18)26;1-8-12(6-9(7-16-8)14(19)20)13(18)17-11-4-2-10(15)3-5-11;9-7-2-1-3-11-4-6(5-12)10-8(7)11;8-5-3-1-2-4(6(5)9)7(10)11;1-2(3)4;1-2/h2-13,35H,14H2,1H3,(H,32,36);2-10,28H,11H2,1H3,(H,25,29);2-11,27H,12H2,1H3,(H,25,28);2-7,19-20H,1H3,(H,17,18);1-4,12H,5H2;1-3,10-11H;1H3,(H,3,4)
• InChIKey: UTKYIJDSZZXIRF-UHFFFAOYSA-N
• XLogP: 16.95
• TPSA: 436.30 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 25
• Rotatable Bonds: 18
• Heavy Atoms: 142
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2199.04
LogP ≤ 5	16.95
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine?

The IUPAC name of acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine (CID 159416166) is acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine.

What is the SMILES notation for acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine?

The canonical SMILES for acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine is BrBr.CC(=O)O.Cc1ncc(-c2cccn3c(-c4cccc(F)c4F)c(CO)nc23)cc1C(=O)Nc1ccc(F)cc1.Cc1ncc(-c2cccn3c(Br)c(CO)nc23)cc1C(=O)Nc1ccc(F)cc1.Cc1ncc(-c2cccn3cc(CO)nc23)cc1C(=O)Nc1ccc(F)cc1.Cc1ncc(B(O)O)cc1C(=O)Nc1ccc(F)cc1.OB(O)c1cccc(F)c1F.OCc1cn2cccc(Br)c2n1.

What is the InChIKey of acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine?

The InChIKey is UTKYIJDSZZXIRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H19F3N4O2.C21H16BrFN4O2.C21H17FN4O2.C13H12BFN2O3.C8H7BrN2O.C6H5BF2O2.C2H4O2.Br2/c1-15-21(27(36)32-18-9-7-17(28)8-10-18)12-16(13-31-15)19-5-3-11-34-25(23(14-35)33-26(19)34)20-4-2-6-22(29)24(20)30;1-12-17(21(29)25-15-6-4-14(23)5-7-15)9-13(10-24-12)16-3-2-8-27-19(22)18(11-28)26-20(16)27;1-13-19(21(28)25-16-6-4-15(22)5-7-16)9-14(10-23-13)18-3-2-8-26-11-17(12-27)24-20(18)26;1-8-12(6-9(7-16-8)14(19)20)13(18)17-11-4-2-10(15)3-5-11;9-7-2-1-3-11-4-6(5-12)10-8(7)11;8-5-3-1-2-4(6(5)9)7(10)11;1-2(3)4;1-2/h2-13,35H,14H2,1H3,(H,32,36);2-10,28H,11H2,1H3,(H,25,29);2-11,27H,12H2,1H3,(H,25,28);2-7,19-20H,1H3,(H,17,18);1-4,12H,5H2;1-3,10-11H;1H3,(H,3,4);.

What are the key properties of acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine?

acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine has a molecular weight of 2199.04 g/mol, XLogP of 16.95, 18 rotatable bonds, 13 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for acetic acid;5-[3-bromo-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;(8-bromoimidazo[1,2-a]pyridin-2-yl)methanol;(2,3-difluorophenyl)boronic acid;5-[3-(2,3-difluorophenyl)-2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-N-(4-fluorophenyl)-2-methylpyridine-3-carboxamide;[5-[(4-fluorophenyl)carbamoyl]-6-methyl-3-pyridinyl]boronic acid;N-(4-fluorophenyl)-5-[2-(hydroxymethyl)imidazo[1,2-a]pyridin-8-yl]-2-methylpyridine-3-carboxamide;molecular bromine is sourced from PubChem (CID 159416166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).