4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide

C116H122Cl8F3N21O12 — CID 159613139

About 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide

4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 159613139) has the molecular formula C116H122Cl8F3N21O12 and a molecular weight of 2343.00 g/mol. Its IUPAC name is 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

• Compound Name: 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide
• PubChem CID: 159613139
• Molecular Formula: C116H122Cl8F3N21O12
• Molecular Weight: 2343.00 g/mol
• Exact Mass: 2337.70
• IUPAC Name: 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide
• SMILES: COCCCn1nc(C)c2c(Cl)c(C(=O)Nc3ccc(C(C)C)cc3)cnc21.COCCCn1nc(C)c2c(Cl)c(C(=O)Nc3ccc(C)cc3)cnc21.COCCCn1nc(C)c2c(Cl)c(C(=O)Nc3ccc(Cl)cc3)cnc21.COCCn1cc(C)c2c(Cl)c(C(=O)Nc3ccc(C(C)C)cc3)cnc21.COCCn1cc(C)c2c(Cl)c(C(=O)Nc3ccc(C(F)(F)F)cc3)cnc21.COCCn1cc(C)c2c(Cl)c(C(=O)Nc3ccc(Cl)cc3)cnc21
• InChI: InChI=1S/C21H25ClN4O2.C21H24ClN3O2.C19H17ClF3N3O2.C19H21ClN4O2.C18H18Cl2N4O2.C18H17Cl2N3O2/c1-13(2)15-6-8-16(9-7-15)24-21(27)17-12-23-20-18(19(17)22)14(3)25-26(20)10-5-11-28-4;1-13(2)15-5-7-16(8-6-15)24-21(26)17-11-23-20-18(19(17)22)14(3)12-25(20)9-10-27-4;1-11-10-26(7-8-28-2)17-15(11)16(20)14(9-24-17)18(27)25-13-5-3-12(4-6-13)19(21,22)23;1-12-5-7-14(8-6-12)22-19(25)15-11-21-18-16(17(15)20)13(2)23-24(18)9-4-10-26-3;1-11-15-16(20)14(18(25)22-13-6-4-12(19)5-7-13)10-21-17(15)24(23-11)8-3-9-26-2;1-11-10-23(7-8-25-2)17-15(11)16(20)14(9-21-17)18(24)22-13-5-3-12(19)4-6-13/h6-9,12-13H,5,10-11H2,1-4H3,(H,24,27);5-8,11-13H,9-10H2,1-4H3,(H,24,26);3-6,9-10H,7-8H2,1-2H3,(H,25,27);5-8,11H,4,9-10H2,1-3H3,(H,22,25);4-7,10H,3,8-9H2,1-2H3,(H,22,25);3-6,9-10H,7-8H2,1-2H3,(H,22,24)
• InChIKey: MMYMKKFCLAWEHO-UHFFFAOYSA-N
• XLogP: 27.62
• TPSA: 375.57 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 27
• Rotatable Bonds: 35
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2343.00
LogP ≤ 5	27.62
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide?

The IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide (CID 159613139) is 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide.

What is the SMILES notation for 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide?

The canonical SMILES for 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide is COCCCn1nc(C)c2c(Cl)c(C(=O)Nc3ccc(C(C)C)cc3)cnc21.COCCCn1nc(C)c2c(Cl)c(C(=O)Nc3ccc(C)cc3)cnc21.COCCCn1nc(C)c2c(Cl)c(C(=O)Nc3ccc(Cl)cc3)cnc21.COCCn1cc(C)c2c(Cl)c(C(=O)Nc3ccc(C(C)C)cc3)cnc21.COCCn1cc(C)c2c(Cl)c(C(=O)Nc3ccc(C(F)(F)F)cc3)cnc21.COCCn1cc(C)c2c(Cl)c(C(=O)Nc3ccc(Cl)cc3)cnc21.

What is the InChIKey of 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide?

The InChIKey is MMYMKKFCLAWEHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25ClN4O2.C21H24ClN3O2.C19H17ClF3N3O2.C19H21ClN4O2.C18H18Cl2N4O2.C18H17Cl2N3O2/c1-13(2)15-6-8-16(9-7-15)24-21(27)17-12-23-20-18(19(17)22)14(3)25-26(20)10-5-11-28-4;1-13(2)15-5-7-16(8-6-15)24-21(26)17-11-23-20-18(19(17)22)14(3)12-25(20)9-10-27-4;1-11-10-26(7-8-28-2)17-15(11)16(20)14(9-24-17)18(27)25-13-5-3-12(4-6-13)19(21,22)23;1-12-5-7-14(8-6-12)22-19(25)15-11-21-18-16(17(15)20)13(2)23-24(18)9-4-10-26-3;1-11-15-16(20)14(18(25)22-13-6-4-12(19)5-7-13)10-21-17(15)24(23-11)8-3-9-26-2;1-11-10-23(7-8-25-2)17-15(11)16(20)14(9-21-17)18(24)22-13-5-3-12(19)4-6-13/h6-9,12-13H,5,10-11H2,1-4H3,(H,24,27);5-8,11-13H,9-10H2,1-4H3,(H,24,26);3-6,9-10H,7-8H2,1-2H3,(H,25,27);5-8,11H,4,9-10H2,1-3H3,(H,22,25);4-7,10H,3,8-9H2,1-2H3,(H,22,25);3-6,9-10H,7-8H2,1-2H3,(H,22,24).

What are the key properties of 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide?

4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 2343.00 g/mol, XLogP of 27.62, 35 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-N-(4-chlorophenyl)-1-(2-methoxyethyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-(3-methoxypropyl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(2-methoxyethyl)-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(3-methoxypropyl)-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 159613139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).