6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid

C120H105BrClF7N16O13 — CID 160560911

About 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid

6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid (PubChem CID 160560911) has the molecular formula C120H105BrClF7N16O13 and a molecular weight of 2227.60 g/mol. Its IUPAC name is 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid.

Molecular Properties

• Compound Name: 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
• PubChem CID: 160560911
• Molecular Formula: C120H105BrClF7N16O13
• Molecular Weight: 2227.60 g/mol
• Exact Mass: 2224.68
• IUPAC Name: 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
• SMILES: CC(F)(F)c1cc(CCc2ccc3nccn3c2C(=O)O)cc(C(F)(F)F)c1.CC(F)(F)c1ccc(Cl)c(CCc2ccc3nccn3c2C(=O)O)c1.COc1cc(C)ccc1CCc1ccc2nccn2c1-c1nn[nH]n1.COc1ccc(-c2cccc(CCc3ccc4nccn4c3C(=O)O)c2)cc1.O=C(O)c1c(CCC2CCCc3cc(Oc4ccccc4)ccc32)ccc2nccn12.O=C(O)c1c(CCc2cccc(Br)c2)ccc2nccn12
• InChI: InChI=1S/C26H24N2O3.C23H20N2O3.C19H15F5N2O2.C18H15ClF2N2O2.C18H18N6O.C16H13BrN2O2/c29-26(30)25-19(11-14-24-27-15-16-28(24)25)10-9-18-5-4-6-20-17-22(12-13-23(18)20)31-21-7-2-1-3-8-21;1-28-20-10-7-17(8-11-20)19-4-2-3-16(15-19)5-6-18-9-12-21-24-13-14-25(21)22(18)23(26)27;1-18(20,21)13-8-11(9-14(10-13)19(22,23)24)2-3-12-4-5-15-25-6-7-26(15)16(12)17(27)28;1-18(20,21)13-5-6-14(19)12(10-13)3-2-11-4-7-15-22-8-9-23(15)16(11)17(24)25;1-12-3-4-13(15(11-12)25-2)5-6-14-7-8-16-19-9-10-24(16)17(14)18-20-22-23-21-18;17-13-3-1-2-11(10-13)4-5-12-6-7-14-18-8-9-19(14)15(12)16(20)21/h1-3,7-8,11-18H,4-6,9-10H2,(H,29,30);2-4,7-15H,5-6H2,1H3,(H,26,27);4-10H,2-3H2,1H3,(H,27,28);4-10H,2-3H2,1H3,(H,24,25);3-4,7-11H,5-6H2,1-2H3,(H,20,21,22,23);1-3,6-10H,4-5H2,(H,20,21)
• InChIKey: QZHICMUYQGDEMB-UHFFFAOYSA-N
• XLogP: 26.10
• TPSA: 372.45 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 23
• Rotatable Bonds: 31
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2227.60
LogP ≤ 5	26.10
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?

The IUPAC name of 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid (CID 160560911) is 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid.

What is the SMILES notation for 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?

The canonical SMILES for 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid is CC(F)(F)c1cc(CCc2ccc3nccn3c2C(=O)O)cc(C(F)(F)F)c1.CC(F)(F)c1ccc(Cl)c(CCc2ccc3nccn3c2C(=O)O)c1.COc1cc(C)ccc1CCc1ccc2nccn2c1-c1nn[nH]n1.COc1ccc(-c2cccc(CCc3ccc4nccn4c3C(=O)O)c2)cc1.O=C(O)c1c(CCC2CCCc3cc(Oc4ccccc4)ccc32)ccc2nccn12.O=C(O)c1c(CCc2cccc(Br)c2)ccc2nccn12.

What is the InChIKey of 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?

The InChIKey is QZHICMUYQGDEMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O3.C23H20N2O3.C19H15F5N2O2.C18H15ClF2N2O2.C18H18N6O.C16H13BrN2O2/c29-26(30)25-19(11-14-24-27-15-16-28(24)25)10-9-18-5-4-6-20-17-22(12-13-23(18)20)31-21-7-2-1-3-8-21;1-28-20-10-7-17(8-11-20)19-4-2-3-16(15-19)5-6-18-9-12-21-24-13-14-25(21)22(18)23(26)27;1-18(20,21)13-8-11(9-14(10-13)19(22,23)24)2-3-12-4-5-15-25-6-7-26(15)16(12)17(27)28;1-18(20,21)13-5-6-14(19)12(10-13)3-2-11-4-7-15-22-8-9-23(15)16(11)17(24)25;1-12-3-4-13(15(11-12)25-2)5-6-14-7-8-16-19-9-10-24(16)17(14)18-20-22-23-21-18;17-13-3-1-2-11(10-13)4-5-12-6-7-14-18-8-9-19(14)15(12)16(20)21/h1-3,7-8,11-18H,4-6,9-10H2,(H,29,30);2-4,7-15H,5-6H2,1H3,(H,26,27);4-10H,2-3H2,1H3,(H,27,28);4-10H,2-3H2,1H3,(H,24,25);3-4,7-11H,5-6H2,1-2H3,(H,20,21,22,23);1-3,6-10H,4-5H2,(H,20,21).

What are the key properties of 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?

6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid has a molecular weight of 2227.60 g/mol, XLogP of 26.10, 31 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[2-(3-bromophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-chloro-5-(1,1-difluoroethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[3-(1,1-difluoroethyl)-5-(trifluoromethyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(2-methoxy-4-methylphenyl)ethyl]-5-(2H-tetrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-[3-(4-methoxyphenyl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(6-phenoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid is sourced from PubChem (CID 160560911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).