2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone

C191H182Cl2FN39O14 — CID 157230500

About 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone

2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone (PubChem CID 157230500) has the molecular formula C191H182Cl2FN39O14 and a molecular weight of 3337.72 g/mol. Its IUPAC name is 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone.

Molecular Properties

• Compound Name: 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone
• PubChem CID: 157230500
• Molecular Formula: C191H182Cl2FN39O14
• Molecular Weight: 3337.72 g/mol
• Exact Mass: 3334.41
• IUPAC Name: 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone
• SMILES: CCOc1cccc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)c1.COc1ccc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)c(OC)n1.COc1cccc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)c1Cl.Cc1[nH]nc(C(=O)Cc2cnc3[nH]c(-c4cccc(F)c4)cc3c2)c1C.Cc1[nH]nc(C(=O)Cc2cnc3[nH]c(-c4cccc(OC(C)C)c4)cc3c2)c1C.Cc1[nH]nc(C(=O)Cc2cnc3[nH]c(-c4ccccc4Cl)cc3c2)c1C.Cc1[nH]nc(C(=O)Cc2cnc3[nH]c(-c4cncc(C5CC5)c4)cc3c2)c1C.Cc1cc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)cnc1C.Cc1cccc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)c1
• InChI: InChI=1S/C23H24N4O2.C22H21N5O.C22H22N4O2.C21H19ClN4O2.C21H21N5O3.C21H21N5O.C21H20N4O.C20H17ClN4O.C20H17FN4O/c1-13(2)29-19-7-5-6-17(10-19)20-11-18-8-16(12-24-23(18)25-20)9-21(28)22-14(3)15(4)26-27-22;1-12-13(2)26-27-21(12)20(28)6-14-5-16-8-19(25-22(16)24-9-14)18-7-17(10-23-11-18)15-3-4-15;1-4-28-18-7-5-6-16(10-18)19-11-17-8-15(12-23-22(17)24-19)9-20(27)21-13(2)14(3)25-26-21;1-11-12(2)25-26-20(11)17(27)8-13-7-14-9-16(24-21(14)23-10-13)15-5-4-6-18(28-3)19(15)22;1-11-12(2)25-26-19(11)17(27)8-13-7-14-9-16(23-20(14)22-10-13)15-5-6-18(28-3)24-21(15)29-4;1-11-5-17(10-22-13(11)3)18-8-16-6-15(9-23-21(16)24-18)7-19(27)20-12(2)14(4)25-26-20;1-12-5-4-6-16(7-12)18-10-17-8-15(11-22-21(17)23-18)9-19(26)20-13(2)14(3)24-25-20;1-11-12(2)24-25-19(11)18(26)8-13-7-14-9-17(23-20(14)22-10-13)15-5-3-4-6-16(15)21;1-11-12(2)24-25-19(11)18(26)7-13-6-15-9-17(23-20(15)22-10-13)14-4-3-5-16(21)8-14/h5-8,10-13H,9H2,1-4H3,(H,24,25)(H,26,27);5,7-11,15H,3-4,6H2,1-2H3,(H,24,25)(H,26,27);5-8,10-12H,4,9H2,1-3H3,(H,23,24)(H,25,26);4-7,9-10H,8H2,1-3H3,(H,23,24)(H,25,26);5-7,9-10H,8H2,1-4H3,(H,22,23)(H,25,26);5-6,8-10H,7H2,1-4H3,(H,23,24)(H,25,26);4-8,10-11H,9H2,1-3H3,(H,22,23)(H,24,25);3-7,9-10H,8H2,1-2H3,(H,22,23)(H,24,25);3-6,8-10H,7H2,1-2H3,(H,22,23)(H,24,25)
• InChIKey: AUAVMLKUHSIIHK-UHFFFAOYSA-N
• XLogP: 38.60
• TPSA: 754.69 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 35
• Rotatable Bonds: 44
• Heavy Atoms: 247
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3337.72
LogP ≤ 5	38.60
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	35

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone?

The IUPAC name of 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone (CID 157230500) is 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone.

What is the SMILES notation for 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone?

The canonical SMILES for 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone is CCOc1cccc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)c1.COc1ccc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)c(OC)n1.COc1cccc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)c1Cl.Cc1[nH]nc(C(=O)Cc2cnc3[nH]c(-c4cccc(F)c4)cc3c2)c1C.Cc1[nH]nc(C(=O)Cc2cnc3[nH]c(-c4cccc(OC(C)C)c4)cc3c2)c1C.Cc1[nH]nc(C(=O)Cc2cnc3[nH]c(-c4ccccc4Cl)cc3c2)c1C.Cc1[nH]nc(C(=O)Cc2cnc3[nH]c(-c4cncc(C5CC5)c4)cc3c2)c1C.Cc1cc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)cnc1C.Cc1cccc(-c2cc3cc(CC(=O)c4n[nH]c(C)c4C)cnc3[nH]2)c1.

What is the InChIKey of 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone?

The InChIKey is AUAVMLKUHSIIHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2.C22H21N5O.C22H22N4O2.C21H19ClN4O2.C21H21N5O3.C21H21N5O.C21H20N4O.C20H17ClN4O.C20H17FN4O/c1-13(2)29-19-7-5-6-17(10-19)20-11-18-8-16(12-24-23(18)25-20)9-21(28)22-14(3)15(4)26-27-22;1-12-13(2)26-27-21(12)20(28)6-14-5-16-8-19(25-22(16)24-9-14)18-7-17(10-23-11-18)15-3-4-15;1-4-28-18-7-5-6-16(10-18)19-11-17-8-15(12-23-22(17)24-19)9-20(27)21-13(2)14(3)25-26-21;1-11-12(2)25-26-20(11)17(27)8-13-7-14-9-16(24-21(14)23-10-13)15-5-4-6-18(28-3)19(15)22;1-11-12(2)25-26-19(11)17(27)8-13-7-14-9-16(23-20(14)22-10-13)15-5-6-18(28-3)24-21(15)29-4;1-11-5-17(10-22-13(11)3)18-8-16-6-15(9-23-21(16)24-18)7-19(27)20-12(2)14(4)25-26-20;1-12-5-4-6-16(7-12)18-10-17-8-15(11-22-21(17)23-18)9-19(26)20-13(2)14(3)24-25-20;1-11-12(2)24-25-19(11)18(26)8-13-7-14-9-17(23-20(14)22-10-13)15-5-3-4-6-16(15)21;1-11-12(2)24-25-19(11)18(26)7-13-6-15-9-17(23-20(15)22-10-13)14-4-3-5-16(21)8-14/h5-8,10-13H,9H2,1-4H3,(H,24,25)(H,26,27);5,7-11,15H,3-4,6H2,1-2H3,(H,24,25)(H,26,27);5-8,10-12H,4,9H2,1-3H3,(H,23,24)(H,25,26);4-7,9-10H,8H2,1-3H3,(H,23,24)(H,25,26);5-7,9-10H,8H2,1-4H3,(H,22,23)(H,25,26);5-6,8-10H,7H2,1-4H3,(H,23,24)(H,25,26);4-8,10-11H,9H2,1-3H3,(H,22,23)(H,24,25);3-7,9-10H,8H2,1-2H3,(H,22,23)(H,24,25);3-6,8-10H,7H2,1-2H3,(H,22,23)(H,24,25).

What are the key properties of 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone?

2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone has a molecular weight of 3337.72 g/mol, XLogP of 38.60, 44 rotatable bonds, 18 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-(2-chloro-3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(5-cyclopropyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;2-[2-(2,6-dimethoxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-(4,5-dimethyl-1H-pyrazol-3-yl)ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(5,6-dimethyl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-ethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone;1-(4,5-dimethyl-1H-pyrazol-3-yl)-2-[2-(3-propan-2-yloxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]ethanone is sourced from PubChem (CID 157230500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).