4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide

C132H162N26O27 — CID 157259630

About 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide

4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide (PubChem CID 157259630) has the molecular formula C132H162N26O27 and a molecular weight of 2544.90 g/mol. Its IUPAC name is 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide.

Molecular Properties

• Compound Name: 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide
• PubChem CID: 157259630
• Molecular Formula: C132H162N26O27
• Molecular Weight: 2544.90 g/mol
• Exact Mass: 2543.21
• IUPAC Name: 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide
• SMILES: CC(C)(C)C(=O)c1cc2cc(NC(=O)c3ccc(OCCOCCO)cc3)cnc2[nH]1.CC(C)(C)C(=O)c1cc2cc(NC(=O)c3cccc(N)c3)cnc2[nH]1.CC(C)(C)C(=O)c1cc2cc(NC(=O)c3cn(CCOCCO)nn3)cnc2[nH]1.CC(C)(C)C(=O)c1cn2cc(NC(=O)c3ccc(N)cc3)ccc2n1.COCCOCCOCCOCCOc1ccc(C(=O)Nc2cnc3[nH]c(C(=O)C(C)(C)C)cc3c2)cc1O.COCCOCCOCCOCCn1cc(C(=O)Nc2cnc3[nH]c(C(=O)C(C)(C)C)cc3c2)nn1
• InChI: InChI=1S/C28H37N3O8.C24H34N6O6.C23H27N3O5.C19H24N6O4.2C19H20N4O2/c1-28(2,3)25(33)22-16-20-15-21(18-29-26(20)31-22)30-27(34)19-5-6-24(23(32)17-19)39-14-13-38-12-11-37-10-9-36-8-7-35-4;1-24(2,3)21(31)19-14-17-13-18(15-25-22(17)27-19)26-23(32)20-16-30(29-28-20)5-6-34-9-10-36-12-11-35-8-7-33-4;1-23(2,3)20(28)19-13-16-12-17(14-24-21(16)26-19)25-22(29)15-4-6-18(7-5-15)31-11-10-30-9-8-27;1-19(2,3)16(27)14-9-12-8-13(10-20-17(12)22-14)21-18(28)15-11-25(24-23-15)4-6-29-7-5-26;1-19(2,3)17(24)15-11-23-10-14(8-9-16(23)22-15)21-18(25)12-4-6-13(20)7-5-12;1-19(2,3)16(24)15-9-12-8-14(10-21-17(12)23-15)22-18(25)11-5-4-6-13(20)7-11/h5-6,15-18,32H,7-14H2,1-4H3,(H,29,31)(H,30,34);13-16H,5-12H2,1-4H3,(H,25,27)(H,26,32);4-7,12-14,27H,8-11H2,1-3H3,(H,24,26)(H,25,29);8-11,26H,4-7H2,1-3H3,(H,20,22)(H,21,28);4-11H,20H2,1-3H3,(H,21,25);4-10H,20H2,1-3H3,(H,21,23)(H,22,25)
• InChIKey: AXHNLYYIYHGMSW-UHFFFAOYSA-N
• XLogP: 18.26
• TPSA: 722.63 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 42
• Rotatable Bonds: 54
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2544.90
LogP ≤ 5	18.26
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	42

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide?

The IUPAC name of 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide (CID 157259630) is 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide.

What is the SMILES notation for 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide?

The canonical SMILES for 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide is CC(C)(C)C(=O)c1cc2cc(NC(=O)c3ccc(OCCOCCO)cc3)cnc2[nH]1.CC(C)(C)C(=O)c1cc2cc(NC(=O)c3cccc(N)c3)cnc2[nH]1.CC(C)(C)C(=O)c1cc2cc(NC(=O)c3cn(CCOCCO)nn3)cnc2[nH]1.CC(C)(C)C(=O)c1cn2cc(NC(=O)c3ccc(N)cc3)ccc2n1.COCCOCCOCCOCCOc1ccc(C(=O)Nc2cnc3[nH]c(C(=O)C(C)(C)C)cc3c2)cc1O.COCCOCCOCCOCCn1cc(C(=O)Nc2cnc3[nH]c(C(=O)C(C)(C)C)cc3c2)nn1.

What is the InChIKey of 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide?

The InChIKey is AXHNLYYIYHGMSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H37N3O8.C24H34N6O6.C23H27N3O5.C19H24N6O4.2C19H20N4O2/c1-28(2,3)25(33)22-16-20-15-21(18-29-26(20)31-22)30-27(34)19-5-6-24(23(32)17-19)39-14-13-38-12-11-37-10-9-36-8-7-35-4;1-24(2,3)21(31)19-14-17-13-18(15-25-22(17)27-19)26-23(32)20-16-30(29-28-20)5-6-34-9-10-36-12-11-35-8-7-33-4;1-23(2,3)20(28)19-13-16-12-17(14-24-21(16)26-19)25-22(29)15-4-6-18(7-5-15)31-11-10-30-9-8-27;1-19(2,3)16(27)14-9-12-8-13(10-20-17(12)22-14)21-18(28)15-11-25(24-23-15)4-6-29-7-5-26;1-19(2,3)17(24)15-11-23-10-14(8-9-16(23)22-15)21-18(25)12-4-6-13(20)7-5-12;1-19(2,3)16(24)15-9-12-8-14(10-21-17(12)23-15)22-18(25)11-5-4-6-13(20)7-11/h5-6,15-18,32H,7-14H2,1-4H3,(H,29,31)(H,30,34);13-16H,5-12H2,1-4H3,(H,25,27)(H,26,32);4-7,12-14,27H,8-11H2,1-3H3,(H,24,26)(H,25,29);8-11,26H,4-7H2,1-3H3,(H,20,22)(H,21,28);4-11H,20H2,1-3H3,(H,21,25);4-10H,20H2,1-3H3,(H,21,23)(H,22,25).

What are the key properties of 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide?

4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide has a molecular weight of 2544.90 g/mol, XLogP of 18.26, 54 rotatable bonds, 16 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for 4-amino-N-[2-(2,2-dimethylpropanoyl)imidazo[1,2-a]pyridin-6-yl]benzamide;3-amino-N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-[2-(2-hydroxyethoxy)ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-3-hydroxy-4-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzamide;N-[2-(2,2-dimethylpropanoyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]triazole-4-carboxamide is sourced from PubChem (CID 157259630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).