N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide

C36H62N8O5Si — CID 174054496

About N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide

N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide (PubChem CID 174054496) has the molecular formula C36H62N8O5Si and a molecular weight of 715.03 g/mol. Its IUPAC name is N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide.

Molecular Properties

• Compound Name: N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide
• PubChem CID: 174054496
• Molecular Formula: C36H62N8O5Si
• Molecular Weight: 715.03 g/mol
• Exact Mass: 714.46
• IUPAC Name: N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide
• SMILES: CC1CCC(C(C)(C)C)N(C(=O)C(=O)Nc2cnc(N)c3cnn(COCC[Si](C)(C)C)c23)C1.CC1CCC(C(C)(C)C)N(C(=O)C(N)=O)C1
• InChI: InChI=1S/C24H40N6O3Si.C12H22N2O2/c1-16-8-9-19(24(2,3)4)29(14-16)23(32)22(31)28-18-13-26-21(25)17-12-27-30(20(17)18)15-33-10-11-34(5,6)7;1-8-5-6-9(12(2,3)4)14(7-8)11(16)10(13)15/h12-13,16,19H,8-11,14-15H2,1-7H3,(H2,25,26)(H,28,31);8-9H,5-7H2,1-4H3,(H2,13,15)
• InChIKey: JFOHSIQZOYPLMK-UHFFFAOYSA-N
• XLogP: 5.08
• TPSA: 178.77 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 9
• Rotatable Bonds: 6
• Heavy Atoms: 50
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	715.03
LogP ≤ 5	5.08
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide?

The IUPAC name of N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide (CID 174054496) is N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide.

What is the SMILES notation for N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide?

The canonical SMILES for N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide is CC1CCC(C(C)(C)C)N(C(=O)C(=O)Nc2cnc(N)c3cnn(COCC[Si](C)(C)C)c23)C1.CC1CCC(C(C)(C)C)N(C(=O)C(N)=O)C1.

What is the InChIKey of N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide?

The InChIKey is JFOHSIQZOYPLMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H40N6O3Si.C12H22N2O2/c1-16-8-9-19(24(2,3)4)29(14-16)23(32)22(31)28-18-13-26-21(25)17-12-27-30(20(17)18)15-33-10-11-34(5,6)7;1-8-5-6-9(12(2,3)4)14(7-8)11(16)10(13)15/h12-13,16,19H,8-11,14-15H2,1-7H3,(H2,25,26)(H,28,31);8-9H,5-7H2,1-4H3,(H2,13,15).

What are the key properties of N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide?

N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide has a molecular weight of 715.03 g/mol, XLogP of 5.08, 6 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-amino-1-(2-trimethylsilylethoxymethyl)pyrazolo[4,5-c]pyridin-7-yl]-2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide;2-(2-tert-butyl-5-methylpiperidin-1-yl)-2-oxoacetamide is sourced from PubChem (CID 174054496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).