2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide

C60H68Cl2N16O5Si — CID 158601652

About 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide

2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide (PubChem CID 158601652) has the molecular formula C60H68Cl2N16O5Si and a molecular weight of 1192.30 g/mol. Its IUPAC name is 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide.

Molecular Properties

• Compound Name: 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide
• PubChem CID: 158601652
• Molecular Formula: C60H68Cl2N16O5Si
• Molecular Weight: 1192.30 g/mol
• Exact Mass: 1190.47
• IUPAC Name: 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide
• SMILES: CC(NC(=O)c1c[nH]c2ncc(-c3nn(CCN4CCOCC4)c4cc(Cl)ccc34)nc12)c1cccnc1.CC(NC(=O)c1cn(COCC[Si](C)(C)C)c2ncc(-c3nn(CCN4CCOCC4)c4cc(Cl)ccc34)nc12)c1cccnc1
• InChI: InChI=1S/C33H41ClN8O3Si.C27H27ClN8O2/c1-23(24-6-5-9-35-19-24)37-33(43)27-21-41(22-45-16-17-46(2,3)4)32-31(27)38-28(20-36-32)30-26-8-7-25(34)18-29(26)42(39-30)11-10-40-12-14-44-15-13-40;1-17(18-3-2-6-29-14-18)32-27(37)21-15-30-26-25(21)33-22(16-31-26)24-20-5-4-19(28)13-23(20)36(34-24)8-7-35-9-11-38-12-10-35/h5-9,18-21,23H,10-17,22H2,1-4H3,(H,37,43);2-6,13-17H,7-12H2,1H3,(H,30,31)(H,32,37)
• InChIKey: HVSBIPILITUTGA-UHFFFAOYSA-N
• XLogP: 9.48
• TPSA: 226.07 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 18
• Rotatable Bonds: 19
• Heavy Atoms: 84
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1192.30
LogP ≤ 5	9.48
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide?

The IUPAC name of 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide (CID 158601652) is 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide.

What is the SMILES notation for 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide?

The canonical SMILES for 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide is CC(NC(=O)c1c[nH]c2ncc(-c3nn(CCN4CCOCC4)c4cc(Cl)ccc34)nc12)c1cccnc1.CC(NC(=O)c1cn(COCC[Si](C)(C)C)c2ncc(-c3nn(CCN4CCOCC4)c4cc(Cl)ccc34)nc12)c1cccnc1.

What is the InChIKey of 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide?

The InChIKey is HVSBIPILITUTGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H41ClN8O3Si.C27H27ClN8O2/c1-23(24-6-5-9-35-19-24)37-33(43)27-21-41(22-45-16-17-46(2,3)4)32-31(27)38-28(20-36-32)30-26-8-7-25(34)18-29(26)42(39-30)11-10-40-12-14-44-15-13-40;1-17(18-3-2-6-29-14-18)32-27(37)21-15-30-26-25(21)33-22(16-31-26)24-20-5-4-19(28)13-23(20)36(34-24)8-7-35-9-11-38-12-10-35/h5-9,18-21,23H,10-17,22H2,1-4H3,(H,37,43);2-6,13-17H,7-12H2,1H3,(H,30,31)(H,32,37).

What are the key properties of 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide?

2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide has a molecular weight of 1192.30 g/mol, XLogP of 9.48, 19 rotatable bonds, 3 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide;2-[6-chloro-1-(2-morpholin-4-ylethyl)indazol-3-yl]-N-(1-pyridin-3-ylethyl)-5-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyrazine-7-carboxamide is sourced from PubChem (CID 158601652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).