1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol

C27H66N2O8Si5 — CID 59944116

About 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol

1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol (PubChem CID 59944116) has the molecular formula C27H66N2O8Si5 and a molecular weight of 687.26 g/mol. Its IUPAC name is 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol.

Molecular Properties

• Compound Name: 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol
• PubChem CID: 59944116
• Molecular Formula: C27H66N2O8Si5
• Molecular Weight: 687.26 g/mol
• Exact Mass: 686.37
• IUPAC Name: 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol
• SMILES: C[Si](C)(C)CCCOCC(O)CN1CCN(CC(O)COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O)CC1
• InChI: InChI=1S/C27H66N2O8Si5/c1-38(2,3)20-12-18-33-24-26(30)22-28-14-16-29(17-15-28)23-27(31)25-34-19-13-21-39(4,5)35-41(8,9)37-42(10,11)36-40(6,7)32/h26-27,30-32H,12-25H2,1-11H3
• InChIKey: LMXYJMKGWLDNKU-UHFFFAOYSA-N
• XLogP: 3.83
• TPSA: 113.32 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 10
• Rotatable Bonds: 22
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	687.26
LogP ≤ 5	3.83
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	10

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 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol?

The IUPAC name of 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol (CID 59944116) is 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol.

What is the SMILES notation for 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol?

The canonical SMILES for 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol is C[Si](C)(C)CCCOCC(O)CN1CCN(CC(O)COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O)CC1.

What is the InChIKey of 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol?

The InChIKey is LMXYJMKGWLDNKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H66N2O8Si5/c1-38(2,3)20-12-18-33-24-26(30)22-28-14-16-29(17-15-28)23-27(31)25-34-19-13-21-39(4,5)35-41(8,9)37-42(10,11)36-40(6,7)32/h26-27,30-32H,12-25H2,1-11H3.

What are the key properties of 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol?

1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol has a molecular weight of 687.26 g/mol, XLogP of 3.83, 22 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-[2-hydroxy-3-[3-[[[[hydroxy(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]propyl]piperazin-1-yl]-3-(3-trimethylsilylpropoxy)propan-2-ol is sourced from PubChem (CID 59944116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).