N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine

C26H68N2O4Si6 — CID 102274168

IUPACN,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine
SMILESC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCNCCCCCCNCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C26H68N2O4Si6/c1-33(2,3)29-37(11,12)31-35(7,8)25-19-23-27-21-17-15-16-18-22-28-24-20-26-36(9,10)32-38(13,14)30-34(4,5)6/h27-28H,15-26H2,1-14H3
InChIKeySGBFEXLCISSIDX-UHFFFAOYSA-N
MW641.36 g/mol
LogP8.06
Rot. Bonds23

About N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine

N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine (PubChem CID 102274168) has the molecular formula C26H68N2O4Si6 and a molecular weight of 641.36 g/mol. Its IUPAC name is N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine.

Molecular Properties

Compound NameN,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine
PubChem CID102274168
Molecular FormulaC26H68N2O4Si6
Molecular Weight641.36 g/mol
Exact Mass640.38
IUPAC NameN,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine
SMILESC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCNCCCCCCNCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C26H68N2O4Si6/c1-33(2,3)29-37(11,12)31-35(7,8)25-19-23-27-21-17-15-16-18-22-28-24-20-26-36(9,10)32-38(13,14)30-34(4,5)6/h27-28H,15-26H2,1-14H3
InChIKeySGBFEXLCISSIDX-UHFFFAOYSA-N
XLogP8.06
TPSA60.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds23
Heavy Atoms38
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500641.36
LogP ≤ 58.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine?
The IUPAC name of N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine (CID 102274168) is N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine.
What is the SMILES notation for N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine?
The canonical SMILES for N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine is C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCNCCCCCCNCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C.
What is the InChIKey of N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine?
The InChIKey is SGBFEXLCISSIDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H68N2O4Si6/c1-33(2,3)29-37(11,12)31-35(7,8)25-19-23-27-21-17-15-16-18-22-28-24-20-26-36(9,10)32-38(13,14)30-34(4,5)6/h27-28H,15-26H2,1-14H3.
What are the key properties of N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine?
N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine has a molecular weight of 641.36 g/mol, XLogP of 8.06, 23 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propyl]hexane-1,6-diamine is sourced from PubChem (CID 102274168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).