4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane

C117H147Cl7N20O9S2 — CID 161147562

About 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane

4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane (PubChem CID 161147562) has the molecular formula C117H147Cl7N20O9S2 and a molecular weight of 2289.90 g/mol. Its IUPAC name is 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane.

Molecular Properties

• Compound Name: 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane
• PubChem CID: 161147562
• Molecular Formula: C117H147Cl7N20O9S2
• Molecular Weight: 2289.90 g/mol
• Exact Mass: 2284.89
• IUPAC Name: 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane
• SMILES: C.C.C.C.C.Cc1ccc(NC(=O)c2cnc3c(c(C)cn3CC3CCN(C)CC3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(c(C)cn3CC3CCN(S(C)(=O)=O)CC3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(c(C)cn3CC3CCNCC3)c2Cl)cc1.Cc1cn(CC2CCN(C)CC2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12.Cc1cn(CC2CCN(S(C)(=O)=O)CC2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12
• InChI: InChI=1S/C23H27ClN4O3S.C23H27ClN4O.C22H24Cl2N4O3S.C22H24Cl2N4O.C22H25ClN4O.5CH4/c1-15-4-6-18(7-5-15)26-23(29)19-12-25-22-20(21(19)24)16(2)13-27(22)14-17-8-10-28(11-9-17)32(3,30)31;1-15-4-6-18(7-5-15)26-23(29)19-12-25-22-20(21(19)24)16(2)13-28(22)14-17-8-10-27(3)11-9-17;1-14-12-27(13-15-7-9-28(10-8-15)32(2,30)31)21-19(14)20(24)18(11-25-21)22(29)26-17-5-3-16(23)4-6-17;1-14-12-28(13-15-7-9-27(2)10-8-15)21-19(14)20(24)18(11-25-21)22(29)26-17-5-3-16(23)4-6-17;1-14-3-5-17(6-4-14)26-22(28)18-11-25-21-19(20(18)23)15(2)12-27(21)13-16-7-9-24-10-8-16;;;;;/h4-7,12-13,17H,8-11,14H2,1-3H3,(H,26,29);4-7,12-13,17H,8-11,14H2,1-3H3,(H,26,29);3-6,11-12,15H,7-10,13H2,1-2H3,(H,26,29);3-6,11-12,15H,7-10,13H2,1-2H3,(H,26,29);3-6,11-12,16,24H,7-10,13H2,1-2H3,(H,26,28);5*1H4
• InChIKey: UOGIRQBXYWQAIR-UHFFFAOYSA-N
• XLogP: 26.69
• TPSA: 327.87 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 22
• Rotatable Bonds: 22
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2289.90
LogP ≤ 5	26.69
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane?

The IUPAC name of 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane (CID 161147562) is 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane.

What is the SMILES notation for 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane?

The canonical SMILES for 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane is C.C.C.C.C.Cc1ccc(NC(=O)c2cnc3c(c(C)cn3CC3CCN(C)CC3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(c(C)cn3CC3CCN(S(C)(=O)=O)CC3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(c(C)cn3CC3CCNCC3)c2Cl)cc1.Cc1cn(CC2CCN(C)CC2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12.Cc1cn(CC2CCN(S(C)(=O)=O)CC2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12.

What is the InChIKey of 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane?

The InChIKey is UOGIRQBXYWQAIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27ClN4O3S.C23H27ClN4O.C22H24Cl2N4O3S.C22H24Cl2N4O.C22H25ClN4O.5CH4/c1-15-4-6-18(7-5-15)26-23(29)19-12-25-22-20(21(19)24)16(2)13-27(22)14-17-8-10-28(11-9-17)32(3,30)31;1-15-4-6-18(7-5-15)26-23(29)19-12-25-22-20(21(19)24)16(2)13-28(22)14-17-8-10-27(3)11-9-17;1-14-12-27(13-15-7-9-28(10-8-15)32(2,30)31)21-19(14)20(24)18(11-25-21)22(29)26-17-5-3-16(23)4-6-17;1-14-12-28(13-15-7-9-27(2)10-8-15)21-19(14)20(24)18(11-25-21)22(29)26-17-5-3-16(23)4-6-17;1-14-3-5-17(6-4-14)26-22(28)18-11-25-21-19(20(18)23)15(2)12-27(21)13-16-7-9-24-10-8-16;;;;;/h4-7,12-13,17H,8-11,14H2,1-3H3,(H,26,29);4-7,12-13,17H,8-11,14H2,1-3H3,(H,26,29);3-6,11-12,15H,7-10,13H2,1-2H3,(H,26,29);3-6,11-12,15H,7-10,13H2,1-2H3,(H,26,29);3-6,11-12,16,24H,7-10,13H2,1-2H3,(H,26,28);5*1H4.

What are the key properties of 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane?

4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane has a molecular weight of 2289.90 g/mol, XLogP of 26.69, 22 rotatable bonds, 6 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-methylsulfonylpiperidin-4-yl)methyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrrolo[2,3-b]pyridine-5-carboxamide;methane is sourced from PubChem (CID 161147562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).