2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide

C128H129ClF11N19O13S — CID 167597692

About 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide

2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide (PubChem CID 167597692) has the molecular formula C128H129ClF11N19O13S and a molecular weight of 2418.06 g/mol. Its IUPAC name is 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide.

Molecular Properties

• Compound Name: 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide
• PubChem CID: 167597692
• Molecular Formula: C128H129ClF11N19O13S
• Molecular Weight: 2418.06 g/mol
• Exact Mass: 2415.93
• IUPAC Name: 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide
• SMILES: CCn1c(C(C)(O)c2ccc(C(C)(C)C)cc2)nc2ccc(C(=O)Nc3cccc(C)c3)nc21.CCn1c(C(C)(O)c2ccc(C)cc2)nc2ccc(C(=O)Nc3cccc(C)c3)nc21.CCn1c(C(O)(c2ccc(Cl)cc2)C(F)(F)F)nc2ccc(C(=O)NC(CO)CC(C)C)cc21.CCn1c(C(O)(c2ccc(F)cc2)C(F)(F)F)nc2ccc(C(=O)Nc3ccc(S(=O)(=O)CC4CC4)cc3)nc21.CCn1c(C(O)(c2ccc(F)cc2)C(F)(F)F)nc2ccc(C(=O)Nc3cccc(C)c3)nc21
• InChI: InChI=1S/C28H32N4O2.C27H24F4N4O4S.C25H26N4O2.C24H27ClF3N3O3.C24H20F4N4O2/c1-7-32-24-22(15-16-23(30-24)25(33)29-21-10-8-9-18(2)17-21)31-26(32)28(6,34)20-13-11-19(12-14-20)27(3,4)5;1-2-35-23-21(34-25(35)26(37,27(29,30)31)17-5-7-18(28)8-6-17)13-14-22(33-23)24(36)32-19-9-11-20(12-10-19)40(38,39)15-16-3-4-16;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;1-4-31-20-12-15(21(33)29-18(13-32)11-14(2)3)5-10-19(20)30-22(31)23(34,24(26,27)28)16-6-8-17(25)9-7-16;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/h8-17,34H,7H2,1-6H3,(H,29,33);5-14,16,37H,2-4,15H2,1H3,(H,32,36);6-15,31H,5H2,1-4H3,(H,26,30);5-10,12,14,18,32,34H,4,11,13H2,1-3H3,(H,29,33);4-13,34H,3H2,1-2H3,(H,29,33)
• InChIKey: JHPPTRVJWXSZMJ-UHFFFAOYSA-N
• XLogP: 24.56
• TPSA: 441.68 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 27
• Rotatable Bonds: 31
• Heavy Atoms: 173
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2418.06
LogP ≤ 5	24.56
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide?

The IUPAC name of 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide (CID 167597692) is 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide.

What is the SMILES notation for 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide?

The canonical SMILES for 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide is CCn1c(C(C)(O)c2ccc(C(C)(C)C)cc2)nc2ccc(C(=O)Nc3cccc(C)c3)nc21.CCn1c(C(C)(O)c2ccc(C)cc2)nc2ccc(C(=O)Nc3cccc(C)c3)nc21.CCn1c(C(O)(c2ccc(Cl)cc2)C(F)(F)F)nc2ccc(C(=O)NC(CO)CC(C)C)cc21.CCn1c(C(O)(c2ccc(F)cc2)C(F)(F)F)nc2ccc(C(=O)Nc3ccc(S(=O)(=O)CC4CC4)cc3)nc21.CCn1c(C(O)(c2ccc(F)cc2)C(F)(F)F)nc2ccc(C(=O)Nc3cccc(C)c3)nc21.

What is the InChIKey of 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide?

The InChIKey is JHPPTRVJWXSZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H32N4O2.C27H24F4N4O4S.C25H26N4O2.C24H27ClF3N3O3.C24H20F4N4O2/c1-7-32-24-22(15-16-23(30-24)25(33)29-21-10-8-9-18(2)17-21)31-26(32)28(6,34)20-13-11-19(12-14-20)27(3,4)5;1-2-35-23-21(34-25(35)26(37,27(29,30)31)17-5-7-18(28)8-6-17)13-14-22(33-23)24(36)32-19-9-11-20(12-10-19)40(38,39)15-16-3-4-16;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;1-4-31-20-12-15(21(33)29-18(13-32)11-14(2)3)5-10-19(20)30-22(31)23(34,24(26,27)28)16-6-8-17(25)9-7-16;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/h8-17,34H,7H2,1-6H3,(H,29,33);5-14,16,37H,2-4,15H2,1H3,(H,32,36);6-15,31H,5H2,1-4H3,(H,26,30);5-10,12,14,18,32,34H,4,11,13H2,1-3H3,(H,29,33);4-13,34H,3H2,1-2H3,(H,29,33).

What are the key properties of 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide?

2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide has a molecular weight of 2418.06 g/mol, XLogP of 24.56, 31 rotatable bonds, 11 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(4-tert-butylphenyl)-1-hydroxyethyl]-3-ethyl-N-(3-methylphenyl)imidazo[4,5-b]pyridine-5-carboxamide;2-[1-(4-chlorophenyl)-2,2,2-trifluoro-1-hydroxyethyl]-3-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)benzimidazole-5-carboxamide;N-[4-(cyclopropylmethylsulfonyl)phenyl]-3-ethyl-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]imidazo[4,5-b]pyridine-5-carboxamide is sourced from PubChem (CID 167597692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).