4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide

C24H32ClN3O2Si — CID 68661308

About 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide

4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide (PubChem CID 68661308) has the molecular formula C24H32ClN3O2Si and a molecular weight of 458.08 g/mol. Its IUPAC name is 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide.

Molecular Properties

• Compound Name: 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide
• PubChem CID: 68661308
• Molecular Formula: C24H32ClN3O2Si
• Molecular Weight: 458.08 g/mol
• Exact Mass: 457.20
• IUPAC Name: 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide
• SMILES: CC(C)(CO[Si](C)(C)C(C)(C)C)c1ccc(C(=O)Nc2cn3cc(Cl)ccc3n2)cc1
• InChI: InChI=1S/C24H32ClN3O2Si/c1-23(2,3)31(6,7)30-16-24(4,5)18-10-8-17(9-11-18)22(29)27-20-15-28-14-19(25)12-13-21(28)26-20/h8-15H,16H2,1-7H3,(H,27,29)
• InChIKey: VAMJDCDAKWJKAT-UHFFFAOYSA-N
• XLogP: 6.54
• TPSA: 55.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	458.08
LogP ≤ 5	6.54
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide?

The IUPAC name of 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide (CID 68661308) is 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide.

What is the SMILES notation for 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide?

The canonical SMILES for 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide is CC(C)(CO[Si](C)(C)C(C)(C)C)c1ccc(C(=O)Nc2cn3cc(Cl)ccc3n2)cc1.

What is the InChIKey of 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide?

The InChIKey is VAMJDCDAKWJKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32ClN3O2Si/c1-23(2,3)31(6,7)30-16-24(4,5)18-10-8-17(9-11-18)22(29)27-20-15-28-14-19(25)12-13-21(28)26-20/h8-15H,16H2,1-7H3,(H,27,29).

What are the key properties of 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide?

4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide has a molecular weight of 458.08 g/mol, XLogP of 6.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[1-[tert-butyl(dimethyl)silyl]oxy-2-methylpropan-2-yl]-N-(6-chloroimidazo[1,2-a]pyridin-2-yl)benzamide is sourced from PubChem (CID 68661308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).