6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate

C113H102FN13O14 — CID 159590929

About 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate

6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate (PubChem CID 159590929) has the molecular formula C113H102FN13O14 and a molecular weight of 1885.13 g/mol. Its IUPAC name is 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate.

Molecular Properties

• Compound Name: 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate
• PubChem CID: 159590929
• Molecular Formula: C113H102FN13O14
• Molecular Weight: 1885.13 g/mol
• Exact Mass: 1883.77
• IUPAC Name: 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate
• SMILES: Cc1ccc(CCc2ccc3nccn3c2C(=O)O)cc1C.Cc1ccc(CCc2ccc3nccn3c2C(=O)O)cc1F.Cc1ccc(CCc2ccc3nccn3c2C(=O)O)cc1O.Cc1ccc(Oc2ccc(CCc3ccc4nccn4c3C(=O)O)cc2)cc1.Cc1cccc(CCc2ccc3nccn3c2C(=O)O)c1.O=COc1c(NCc2cccc(-c3ccccc3)c2)ccc2nccn12
• InChI: InChI=1S/C23H20N2O3.C21H17N3O2.C18H18N2O2.C17H15FN2O2.C17H16N2O3.C17H16N2O2/c1-16-2-9-19(10-3-16)28-20-11-5-17(6-12-20)4-7-18-8-13-21-24-14-15-25(21)22(18)23(26)27;25-15-26-21-19(9-10-20-22-11-12-24(20)21)23-14-16-5-4-8-18(13-16)17-6-2-1-3-7-17;1-12-3-4-14(11-13(12)2)5-6-15-7-8-16-19-9-10-20(16)17(15)18(21)22;1-11-2-3-12(10-14(11)18)4-5-13-6-7-15-19-8-9-20(15)16(13)17(21)22;1-11-2-3-12(10-14(11)20)4-5-13-6-7-15-18-8-9-19(15)16(13)17(21)22;1-12-3-2-4-13(11-12)5-6-14-7-8-15-18-9-10-19(15)16(14)17(20)21/h2-3,5-6,8-15H,4,7H2,1H3,(H,26,27);1-13,15,23H,14H2;3-4,7-11H,5-6H2,1-2H3,(H,21,22);2-3,6-10H,4-5H2,1H3,(H,21,22);2-3,6-10,20H,4-5H2,1H3,(H,21,22);2-4,7-11H,5-6H2,1H3,(H,20,21)
• InChIKey: MKFOJWQZMKCWQX-UHFFFAOYSA-N
• XLogP: 21.72
• TPSA: 358.09 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 22
• Rotatable Bonds: 28
• Heavy Atoms: 141
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1885.13
LogP ≤ 5	21.72
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate?

The IUPAC name of 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate (CID 159590929) is 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate.

What is the SMILES notation for 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate?

The canonical SMILES for 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate is Cc1ccc(CCc2ccc3nccn3c2C(=O)O)cc1C.Cc1ccc(CCc2ccc3nccn3c2C(=O)O)cc1F.Cc1ccc(CCc2ccc3nccn3c2C(=O)O)cc1O.Cc1ccc(Oc2ccc(CCc3ccc4nccn4c3C(=O)O)cc2)cc1.Cc1cccc(CCc2ccc3nccn3c2C(=O)O)c1.O=COc1c(NCc2cccc(-c3ccccc3)c2)ccc2nccn12.

What is the InChIKey of 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate?

The InChIKey is MKFOJWQZMKCWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3.C21H17N3O2.C18H18N2O2.C17H15FN2O2.C17H16N2O3.C17H16N2O2/c1-16-2-9-19(10-3-16)28-20-11-5-17(6-12-20)4-7-18-8-13-21-24-14-15-25(21)22(18)23(26)27;25-15-26-21-19(9-10-20-22-11-12-24(20)21)23-14-16-5-4-8-18(13-16)17-6-2-1-3-7-17;1-12-3-4-14(11-13(12)2)5-6-15-7-8-16-19-9-10-20(16)17(15)18(21)22;1-11-2-3-12(10-14(11)18)4-5-13-6-7-15-19-8-9-20(15)16(13)17(21)22;1-11-2-3-12(10-14(11)20)4-5-13-6-7-15-18-8-9-19(15)16(13)17(21)22;1-12-3-2-4-13(11-12)5-6-14-7-8-15-18-9-10-19(15)16(14)17(20)21/h2-3,5-6,8-15H,4,7H2,1H3,(H,26,27);1-13,15,23H,14H2;3-4,7-11H,5-6H2,1-2H3,(H,21,22);2-3,6-10H,4-5H2,1H3,(H,21,22);2-3,6-10,20H,4-5H2,1H3,(H,21,22);2-4,7-11H,5-6H2,1H3,(H,20,21).

What are the key properties of 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate?

6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate has a molecular weight of 1885.13 g/mol, XLogP of 21.72, 28 rotatable bonds, 7 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[2-(3,4-dimethylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-fluoro-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-hydroxy-4-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-[4-(4-methylphenoxy)phenyl]ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;6-[2-(3-methylphenyl)ethyl]imidazo[1,2-a]pyridine-5-carboxylic acid;[6-[(3-phenylphenyl)methylamino]imidazo[1,2-a]pyridin-5-yl] formate is sourced from PubChem (CID 159590929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).