6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid

C106H98ClF5N14O13 — CID 160885975

About 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid

6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid (PubChem CID 160885975) has the molecular formula C106H98ClF5N14O13 and a molecular weight of 1906.48 g/mol. Its IUPAC name is 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid.

Molecular Properties

• Compound Name: 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
• PubChem CID: 160885975
• Molecular Formula: C106H98ClF5N14O13
• Molecular Weight: 1906.48 g/mol
• Exact Mass: 1904.70
• IUPAC Name: 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid
• SMILES: CN1CCN(c2ccccc2CCc2ccc3nccn3c2C(=O)O)CC1.COc1cc(CCc2ccc3nccn3c2C(=O)O)ccc1C.Cc1cc(CCc2ccc3nccn3c2C(=O)O)cc(F)c1F.Cc1cc(CCc2ccc3nccn3c2C(=O)O)ccc1F.Cc1cc(F)cc(CCc2ccc3nccn3c2C(=O)O)c1.O=C(O)c1c(CCc2cc(Cl)ccc2F)ccc2nccn12
• InChI: InChI=1S/C21H24N4O2.C18H18N2O3.C17H14F2N2O2.2C17H15FN2O2.C16H12ClFN2O2/c1-23-12-14-24(15-13-23)18-5-3-2-4-16(18)6-7-17-8-9-19-22-10-11-25(19)20(17)21(26)27;1-12-3-4-13(11-15(12)23-2)5-6-14-7-8-16-19-9-10-20(16)17(14)18(21)22;1-10-8-11(9-13(18)15(10)19)2-3-12-4-5-14-20-6-7-21(14)16(12)17(22)23;1-11-10-12(3-6-14(11)18)2-4-13-5-7-15-19-8-9-20(15)16(13)17(21)22;1-11-8-12(10-14(18)9-11)2-3-13-4-5-15-19-6-7-20(15)16(13)17(21)22;17-12-4-5-13(18)11(9-12)2-1-10-3-6-14-19-7-8-20(14)15(10)16(21)22/h2-5,8-11H,6-7,12-15H2,1H3,(H,26,27);3-4,7-11H,5-6H2,1-2H3,(H,21,22);4-9H,2-3H2,1H3,(H,22,23);3,5-10H,2,4H2,1H3,(H,21,22);4-10H,2-3H2,1H3,(H,21,22);3-9H,1-2H2,(H,21,22)
• InChIKey: SNQFDUUDYRZSIM-UHFFFAOYSA-N
• XLogP: 19.25
• TPSA: 343.31 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 21
• Rotatable Bonds: 26
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1906.48
LogP ≤ 5	19.25
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?

The IUPAC name of 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid (CID 160885975) is 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid.

What is the SMILES notation for 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?

The canonical SMILES for 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid is CN1CCN(c2ccccc2CCc2ccc3nccn3c2C(=O)O)CC1.COc1cc(CCc2ccc3nccn3c2C(=O)O)ccc1C.Cc1cc(CCc2ccc3nccn3c2C(=O)O)cc(F)c1F.Cc1cc(CCc2ccc3nccn3c2C(=O)O)ccc1F.Cc1cc(F)cc(CCc2ccc3nccn3c2C(=O)O)c1.O=C(O)c1c(CCc2cc(Cl)ccc2F)ccc2nccn12.

What is the InChIKey of 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?

The InChIKey is SNQFDUUDYRZSIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2.C18H18N2O3.C17H14F2N2O2.2C17H15FN2O2.C16H12ClFN2O2/c1-23-12-14-24(15-13-23)18-5-3-2-4-16(18)6-7-17-8-9-19-22-10-11-25(19)20(17)21(26)27;1-12-3-4-13(11-15(12)23-2)5-6-14-7-8-16-19-9-10-20(16)17(14)18(21)22;1-10-8-11(9-13(18)15(10)19)2-3-12-4-5-14-20-6-7-21(14)16(12)17(22)23;1-11-10-12(3-6-14(11)18)2-4-13-5-7-15-19-8-9-20(15)16(13)17(21)22;1-11-8-12(10-14(18)9-11)2-3-13-4-5-15-19-6-7-20(15)16(13)17(21)22;17-12-4-5-13(18)11(9-12)2-1-10-3-6-14-19-7-8-20(14)15(10)16(21)22/h2-5,8-11H,6-7,12-15H2,1H3,(H,26,27);3-4,7-11H,5-6H2,1-2H3,(H,21,22);4-9H,2-3H2,1H3,(H,22,23);3,5-10H,2,4H2,1H3,(H,21,22);4-10H,2-3H2,1H3,(H,21,22);3-9H,1-2H2,(H,21,22).

What are the key properties of 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid?

6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid has a molecular weight of 1906.48 g/mol, XLogP of 19.25, 26 rotatable bonds, 6 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[2-(5-chloro-2-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3,4-difluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-5-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(4-fluoro-3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methoxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid is sourced from PubChem (CID 160885975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).