2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid

C93H75BBr3F9N12O10 — CID 167672291

About 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid

2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid (PubChem CID 167672291) has the molecular formula C93H75BBr3F9N12O10 and a molecular weight of 1942.20 g/mol. Its IUPAC name is 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid.

Molecular Properties

• Compound Name: 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid
• PubChem CID: 167672291
• Molecular Formula: C93H75BBr3F9N12O10
• Molecular Weight: 1942.20 g/mol
• Exact Mass: 1938.32
• IUPAC Name: 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid
• SMILES: C.COc1c(C)c(-c2cn3ccc(-c4ccc(OC(F)(F)F)cc4)cc3n2)nc2ccccc12.COc1c(C)c(-c2cn3ccc(Br)cc3n2)nc2ccccc12.COc1c(C)c(C(=O)CBr)nc2ccccc12.Cc1c(-c2cn3ccc(-c4ccc(OC(F)(F)F)cc4)cc3n2)[nH]c2ccccc2c1=O.Nc1cc(Br)ccn1.OB(O)c1ccc(OC(F)(F)F)cc1
• InChI: InChI=1S/C25H18F3N3O2.C24H16F3N3O2.C18H14BrN3O.C13H12BrNO2.C7H6BF3O3.C5H5BrN2.CH4/c1-15-23(30-20-6-4-3-5-19(20)24(15)32-2)21-14-31-12-11-17(13-22(31)29-21)16-7-9-18(10-8-16)33-25(26,27)28;1-14-22(29-19-5-3-2-4-18(19)23(14)31)20-13-30-11-10-16(12-21(30)28-20)15-6-8-17(9-7-15)32-24(25,26)27;1-11-17(15-10-22-8-7-12(19)9-16(22)20-15)21-14-6-4-3-5-13(14)18(11)23-2;1-8-12(11(16)7-14)15-10-6-4-3-5-9(10)13(8)17-2;9-7(10,11)14-6-3-1-5(2-4-6)8(12)13;6-4-1-2-8-5(7)3-4;/h3-14H,1-2H3;2-13H,1H3,(H,29,31);3-10H,1-2H3;3-6H,7H2,1-2H3;1-4,12-13H;1-3H,(H2,7,8);1H4
• InChIKey: UHJUACADGYSIDN-UHFFFAOYSA-N
• XLogP: 22.23
• TPSA: 275.25 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Rotatable Bonds: 14
• Heavy Atoms: 128
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1942.20
LogP ≤ 5	22.23
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid?

The IUPAC name of 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid (CID 167672291) is 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid.

What is the SMILES notation for 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid?

The canonical SMILES for 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid is C.COc1c(C)c(-c2cn3ccc(-c4ccc(OC(F)(F)F)cc4)cc3n2)nc2ccccc12.COc1c(C)c(-c2cn3ccc(Br)cc3n2)nc2ccccc12.COc1c(C)c(C(=O)CBr)nc2ccccc12.Cc1c(-c2cn3ccc(-c4ccc(OC(F)(F)F)cc4)cc3n2)[nH]c2ccccc2c1=O.Nc1cc(Br)ccn1.OB(O)c1ccc(OC(F)(F)F)cc1.

What is the InChIKey of 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid?

The InChIKey is UHJUACADGYSIDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18F3N3O2.C24H16F3N3O2.C18H14BrN3O.C13H12BrNO2.C7H6BF3O3.C5H5BrN2.CH4/c1-15-23(30-20-6-4-3-5-19(20)24(15)32-2)21-14-31-12-11-17(13-22(31)29-21)16-7-9-18(10-8-16)33-25(26,27)28;1-14-22(29-19-5-3-2-4-18(19)23(14)31)20-13-30-11-10-16(12-21(30)28-20)15-6-8-17(9-7-15)32-24(25,26)27;1-11-17(15-10-22-8-7-12(19)9-16(22)20-15)21-14-6-4-3-5-13(14)18(11)23-2;1-8-12(11(16)7-14)15-10-6-4-3-5-9(10)13(8)17-2;9-7(10,11)14-6-3-1-5(2-4-6)8(12)13;6-4-1-2-8-5(7)3-4;/h3-14H,1-2H3;2-13H,1H3,(H,29,31);3-10H,1-2H3;3-6H,7H2,1-2H3;1-4,12-13H;1-3H,(H2,7,8);1H4.

What are the key properties of 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid?

2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid has a molecular weight of 1942.20 g/mol, XLogP of 22.23, 14 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(7-bromoimidazo[1,2-a]pyridin-2-yl)-4-methoxy-3-methylquinoline;2-bromo-1-(4-methoxy-3-methylquinolin-2-yl)ethanone;4-bromopyridin-2-amine;methane;4-methoxy-3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]quinoline;3-methyl-2-[7-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-2-yl]-1H-quinolin-4-one;[4-(trifluoromethoxy)phenyl]boronic acid is sourced from PubChem (CID 167672291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).