3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide

C74H67F8N11O6 — CID 167645989

About 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide

3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide (PubChem CID 167645989) has the molecular formula C74H67F8N11O6 and a molecular weight of 1358.40 g/mol. Its IUPAC name is 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide.

Molecular Properties

• Compound Name: 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide
• PubChem CID: 167645989
• Molecular Formula: C74H67F8N11O6
• Molecular Weight: 1358.40 g/mol
• Exact Mass: 1357.51
• IUPAC Name: 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide
• SMILES: CCn1c(C(C)(O)c2ccc(C)cc2)nc2ccc(C(=O)Nc3cccc(C)c3)nc21.CCn1c(C(O)(c2ccc(F)cc2)C(F)(F)F)nc2ccc(C(=O)Nc3cccc(C)c3)cc21.CCn1c(C(O)(c2ccc(F)cc2)C(F)(F)F)nc2ccc(C(=O)Nc3cccc(C)c3)nc21
• InChI: InChI=1S/C25H21F4N3O2.C25H26N4O2.C24H20F4N4O2/c1-3-32-21-14-16(22(33)30-19-6-4-5-15(2)13-19)7-12-20(21)31-23(32)24(34,25(27,28)29)17-8-10-18(26)11-9-17;1-5-29-22-20(28-24(29)25(4,31)18-11-9-16(2)10-12-18)13-14-21(27-22)23(30)26-19-8-6-7-17(3)15-19;1-3-32-20-18(11-12-19(30-20)21(33)29-17-6-4-5-14(2)13-17)31-22(32)23(34,24(26,27)28)15-7-9-16(25)10-8-15/h4-14,34H,3H2,1-2H3,(H,30,33);6-15,31H,5H2,1-4H3,(H,26,30);4-13,34H,3H2,1-2H3,(H,29,33)
• InChIKey: PWMMIEDCIXHFRL-UHFFFAOYSA-N
• XLogP: 15.08
• TPSA: 227.23 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 14
• Rotatable Bonds: 15
• Heavy Atoms: 99
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1358.40
LogP ≤ 5	15.08
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide?

The IUPAC name of 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide (CID 167645989) is 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide.

What is the SMILES notation for 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide?

The canonical SMILES for 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide is CCn1c(C(C)(O)c2ccc(C)cc2)nc2ccc(C(=O)Nc3cccc(C)c3)nc21.CCn1c(C(O)(c2ccc(F)cc2)C(F)(F)F)nc2ccc(C(=O)Nc3cccc(C)c3)cc21.CCn1c(C(O)(c2ccc(F)cc2)C(F)(F)F)nc2ccc(C(=O)Nc3cccc(C)c3)nc21.

What is the InChIKey of 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide?

The InChIKey is PWMMIEDCIXHFRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21F4N3O2.C25H26N4O2.C24H20F4N4O2/c1-3-32-21-14-16(22(33)30-19-6-4-5-15(2)13-19)7-12-20(21)31-23(32)24(34,25(27,28)29)17-8-10-18(26)11-9-17;1-5-29-22-20(28-24(29)25(4,31)18-11-9-16(2)10-12-18)13-14-21(27-22)23(30)26-19-8-6-7-17(3)15-19;1-3-32-20-18(11-12-19(30-20)21(33)29-17-6-4-5-14(2)13-17)31-22(32)23(34,24(26,27)28)15-7-9-16(25)10-8-15/h4-14,34H,3H2,1-2H3,(H,30,33);6-15,31H,5H2,1-4H3,(H,26,30);4-13,34H,3H2,1-2H3,(H,29,33).

What are the key properties of 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide?

3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide has a molecular weight of 1358.40 g/mol, XLogP of 15.08, 15 rotatable bonds, 6 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 3-ethyl-2-[1-hydroxy-1-(4-methylphenyl)ethyl]-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]benzimidazole-5-carboxamide;3-ethyl-N-(3-methylphenyl)-2-[2,2,2-trifluoro-1-(4-fluorophenyl)-1-hydroxyethyl]imidazo[4,5-b]pyridine-5-carboxamide is sourced from PubChem (CID 167645989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).