2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane

C25H31ClN4OSi — CID 152563745

About 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane

2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane (PubChem CID 152563745) has the molecular formula C25H31ClN4OSi and a molecular weight of 467.09 g/mol. Its IUPAC name is 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane.

Molecular Properties

• Compound Name: 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane
• PubChem CID: 152563745
• Molecular Formula: C25H31ClN4OSi
• Molecular Weight: 467.09 g/mol
• Exact Mass: 466.20
• IUPAC Name: 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane
• SMILES: CC(C)c1c(-c2ccc3nccn3c2)c(-c2ccc(Cl)cc2)nn1COCC[Si](C)(C)C
• InChI: InChI=1S/C25H31ClN4OSi/c1-18(2)25-23(20-8-11-22-27-12-13-29(22)16-20)24(19-6-9-21(26)10-7-19)28-30(25)17-31-14-15-32(3,4)5/h6-13,16,18H,14-15,17H2,1-5H3
• InChIKey: YQAQKIGQZRNKGA-UHFFFAOYSA-N
• XLogP: 6.95
• TPSA: 44.35 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	467.09
LogP ≤ 5	6.95
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

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-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane?

The IUPAC name of 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane (CID 152563745) is 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane.

What is the SMILES notation for 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane?

The canonical SMILES for 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane is CC(C)c1c(-c2ccc3nccn3c2)c(-c2ccc(Cl)cc2)nn1COCC[Si](C)(C)C.

What is the InChIKey of 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane?

The InChIKey is YQAQKIGQZRNKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H31ClN4OSi/c1-18(2)25-23(20-8-11-22-27-12-13-29(22)16-20)24(19-6-9-21(26)10-7-19)28-30(25)17-31-14-15-32(3,4)5/h6-13,16,18H,14-15,17H2,1-5H3.

What are the key properties of 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane?

2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane has a molecular weight of 467.09 g/mol, XLogP of 6.95, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[3-(4-chlorophenyl)-4-imidazo[1,2-a]pyridin-6-yl-5-propan-2-ylpyrazol-1-yl]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 152563745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).