N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide

C89H99N17O9 — CID 165021948

About N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide

N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide (PubChem CID 165021948) has the molecular formula C89H99N17O9 and a molecular weight of 1550.88 g/mol. Its IUPAC name is N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide
• PubChem CID: 165021948
• Molecular Formula: C89H99N17O9
• Molecular Weight: 1550.88 g/mol
• Exact Mass: 1549.78
• IUPAC Name: N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide
• SMILES: CC1CCN(C(=O)c2cnc3c(ccn3-c3ccc(C(=O)N(C)C)cc3)c2)CC1.CNC(=O)c1ccc(-n2ccc3cc(C(=O)N4CCC(C)CC4)cnc32)cc1.CNC(=O)c1cncc(-n2ccc3cc(C(=O)N4CCCCC4)cnc32)c1.COCCNC(=O)c1ccc(-n2ccc3cc(C(=O)N4CCC(C)CC4)cnc32)cc1
• InChI: InChI=1S/C24H28N4O3.C23H26N4O2.C22H24N4O2.C20H21N5O2/c1-17-7-11-27(12-8-17)24(30)20-15-19-9-13-28(22(19)26-16-20)21-5-3-18(4-6-21)23(29)25-10-14-31-2;1-16-8-11-26(12-9-16)23(29)19-14-18-10-13-27(21(18)24-15-19)20-6-4-17(5-7-20)22(28)25(2)3;1-15-7-10-25(11-8-15)22(28)18-13-17-9-12-26(20(17)24-14-18)19-5-3-16(4-6-19)21(27)23-2;1-21-19(26)15-10-17(13-22-11-15)25-8-5-14-9-16(12-23-18(14)25)20(27)24-6-3-2-4-7-24/h3-6,9,13,15-17H,7-8,10-12,14H2,1-2H3,(H,25,29);4-7,10,13-16H,8-9,11-12H2,1-3H3;3-6,9,12-15H,7-8,10-11H2,1-2H3,(H,23,27);5,8-13H,2-4,6-7H2,1H3,(H,21,26)
• InChIKey: LHGZAVUNCHWKFI-UHFFFAOYSA-N
• XLogP: 12.54
• TPSA: 282.25 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 18
• Rotatable Bonds: 15
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1550.88
LogP ≤ 5	12.54
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide?

The IUPAC name of N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide (CID 165021948) is N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide.

What is the SMILES notation for N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide?

The canonical SMILES for N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide is CC1CCN(C(=O)c2cnc3c(ccn3-c3ccc(C(=O)N(C)C)cc3)c2)CC1.CNC(=O)c1ccc(-n2ccc3cc(C(=O)N4CCC(C)CC4)cnc32)cc1.CNC(=O)c1cncc(-n2ccc3cc(C(=O)N4CCCCC4)cnc32)c1.COCCNC(=O)c1ccc(-n2ccc3cc(C(=O)N4CCC(C)CC4)cnc32)cc1.

What is the InChIKey of N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide?

The InChIKey is LHGZAVUNCHWKFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O3.C23H26N4O2.C22H24N4O2.C20H21N5O2/c1-17-7-11-27(12-8-17)24(30)20-15-19-9-13-28(22(19)26-16-20)21-5-3-18(4-6-21)23(29)25-10-14-31-2;1-16-8-11-26(12-9-16)23(29)19-14-18-10-13-27(21(18)24-15-19)20-6-4-17(5-7-20)22(28)25(2)3;1-15-7-10-25(11-8-15)22(28)18-13-17-9-12-26(20(17)24-14-18)19-5-3-16(4-6-19)21(27)23-2;1-21-19(26)15-10-17(13-22-11-15)25-8-5-14-9-16(12-23-18(14)25)20(27)24-6-3-2-4-7-24/h3-6,9,13,15-17H,7-8,10-12,14H2,1-2H3,(H,25,29);4-7,10,13-16H,8-9,11-12H2,1-3H3;3-6,9,12-15H,7-8,10-11H2,1-2H3,(H,23,27);5,8-13H,2-4,6-7H2,1H3,(H,21,26).

What are the key properties of N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide?

N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide has a molecular weight of 1550.88 g/mol, XLogP of 12.54, 15 rotatable bonds, 3 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-dimethyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-(2-methoxyethyl)-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-4-[5-(4-methylpiperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]benzamide;N-methyl-5-[5-(piperidine-1-carbonyl)pyrrolo[2,3-b]pyridin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 165021948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).