2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid)

C136H132F6N34O15S — CID 173145609

About 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid)

2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid) (PubChem CID 173145609) has the molecular formula C136H132F6N34O15S and a molecular weight of 2628.83 g/mol. Its IUPAC name is 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid).

Molecular Properties

• Compound Name: 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid)
• PubChem CID: 173145609
• Molecular Formula: C136H132F6N34O15S
• Molecular Weight: 2628.83 g/mol
• Exact Mass: 2627.02
• IUPAC Name: 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid)
• SMILES: CCc1c(CO)cccc1Nc1c(C(N)=O)cnc2nc(-c3ccccc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3ccc(N(C)C)cc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3ccc(N4CCOCC4)cc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3ccc(OC)cc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3ccc(S(C)(=O)=O)cc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3cnc[nH]3)[nH]c12.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F
• InChI: InChI=1S/C25H26N6O2.C23H24N6O.C22H21N5O3S.2C22H21N5O2.C18H17N7O.2C2HF3O2/c1-2-16-5-3-4-6-20(16)28-21-19(23(26)32)15-27-25-22(21)29-24(30-25)17-7-9-18(10-8-17)31-11-13-33-14-12-31;1-4-14-7-5-6-8-18(14)26-19-17(21(24)30)13-25-23-20(19)27-22(28-23)15-9-11-16(12-10-15)29(2)3;1-3-13-6-4-5-7-17(13)25-18-16(20(23)28)12-24-22-19(18)26-21(27-22)14-8-10-15(11-9-14)31(2,29)30;1-3-13-6-4-5-7-17(13)25-18-16(20(23)28)12-24-22-19(18)26-21(27-22)14-8-10-15(29-2)11-9-14;1-2-15-14(12-28)9-6-10-17(15)25-18-16(20(23)29)11-24-22-19(18)26-21(27-22)13-7-4-3-5-8-13;1-2-10-5-3-4-6-12(10)23-14-11(16(19)26)7-21-18-15(14)24-17(25-18)13-8-20-9-22-13;2*3-2(4,5)1(6)7/h3-10,15H,2,11-14H2,1H3,(H2,26,32)(H2,27,28,29,30);5-13H,4H2,1-3H3,(H2,24,30)(H2,25,26,27,28);4-12H,3H2,1-2H3,(H2,23,28)(H2,24,25,26,27);4-12H,3H2,1-2H3,(H2,23,28)(H2,24,25,26,27);3-11,28H,2,12H2,1H3,(H2,23,29)(H2,24,25,26,27);3-9H,2H2,1H3,(H2,19,26)(H,20,22)(H2,21,23,24,25);2*(H,6,7)
• InChIKey: VDBWSQMMEXRCDD-UHFFFAOYSA-N
• XLogP: 22.98
• TPSA: 762.73 Ų
• H-Bond Donors: 22
• H-Bond Acceptors: 34
• Rotatable Bonds: 35
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2628.83
LogP ≤ 5	22.98
H-Bond Donors ≤ 5	22
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_G(9)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid)?

The IUPAC name of 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid) (CID 173145609) is 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid).

What is the SMILES notation for 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid)?

The canonical SMILES for 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid) is CCc1c(CO)cccc1Nc1c(C(N)=O)cnc2nc(-c3ccccc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3ccc(N(C)C)cc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3ccc(N4CCOCC4)cc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3ccc(OC)cc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3ccc(S(C)(=O)=O)cc3)[nH]c12.CCc1ccccc1Nc1c(C(N)=O)cnc2nc(-c3cnc[nH]3)[nH]c12.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.

What is the InChIKey of 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid)?

The InChIKey is VDBWSQMMEXRCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N6O2.C23H24N6O.C22H21N5O3S.2C22H21N5O2.C18H17N7O.2C2HF3O2/c1-2-16-5-3-4-6-20(16)28-21-19(23(26)32)15-27-25-22(21)29-24(30-25)17-7-9-18(10-8-17)31-11-13-33-14-12-31;1-4-14-7-5-6-8-18(14)26-19-17(21(24)30)13-25-23-20(19)27-22(28-23)15-9-11-16(12-10-15)29(2)3;1-3-13-6-4-5-7-17(13)25-18-16(20(23)28)12-24-22-19(18)26-21(27-22)14-8-10-15(11-9-14)31(2,29)30;1-3-13-6-4-5-7-17(13)25-18-16(20(23)28)12-24-22-19(18)26-21(27-22)14-8-10-15(29-2)11-9-14;1-2-15-14(12-28)9-6-10-17(15)25-18-16(20(23)29)11-24-22-19(18)26-21(27-22)13-7-4-3-5-8-13;1-2-10-5-3-4-6-12(10)23-14-11(16(19)26)7-21-18-15(14)24-17(25-18)13-8-20-9-22-13;2*3-2(4,5)1(6)7/h3-10,15H,2,11-14H2,1H3,(H2,26,32)(H2,27,28,29,30);5-13H,4H2,1-3H3,(H2,24,30)(H2,25,26,27,28);4-12H,3H2,1-2H3,(H2,23,28)(H2,24,25,26,27);4-12H,3H2,1-2H3,(H2,23,28)(H2,24,25,26,27);3-11,28H,2,12H2,1H3,(H2,23,29)(H2,24,25,26,27);3-9H,2H2,1H3,(H2,19,26)(H,20,22)(H2,21,23,24,25);2*(H,6,7).

What are the key properties of 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid)?

2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid) has a molecular weight of 2628.83 g/mol, XLogP of 22.98, 35 rotatable bonds, 22 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(dimethylamino)phenyl]-7-(2-ethylanilino)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(1H-imidazol-5-yl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-methylsulfonylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-(2-ethylanilino)-2-(4-morpholin-4-ylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide;7-[2-ethyl-3-(hydroxymethyl)anilino]-2-phenyl-1H-imidazo[4,5-b]pyridine-6-carboxamide;bis(2,2,2-trifluoroacetic acid) is sourced from PubChem (CID 173145609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).