[dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane

C18H42N4O5Si2 — CID 141466388

IUPAC[dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane
SMILESCO[Si](CCCN1CCNCC1)(OC)O[Si](CCCN1CCNCC1)(OC)OC
InChIInChI=1S/C18H42N4O5Si2/c1-23-28(24-2,17-5-11-21-13-7-19-8-14-21)27-29(25-3,26-4)18-6-12-22-15-9-20-10-16-22/h19-20H,5-18H2,1-4H3
InChIKeyJIFJXAKYOQUKQP-UHFFFAOYSA-N
MW450.73 g/mol
LogP0.06
Rot. Bonds14

About [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane

[dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane (PubChem CID 141466388) has the molecular formula C18H42N4O5Si2 and a molecular weight of 450.73 g/mol. Its IUPAC name is [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane.

Molecular Properties

Compound Name[dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane
PubChem CID141466388
Molecular FormulaC18H42N4O5Si2
Molecular Weight450.73 g/mol
Exact Mass450.27
IUPAC Name[dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane
SMILESCO[Si](CCCN1CCNCC1)(OC)O[Si](CCCN1CCNCC1)(OC)OC
InChIInChI=1S/C18H42N4O5Si2/c1-23-28(24-2,17-5-11-21-13-7-19-8-14-21)27-29(25-3,26-4)18-6-12-22-15-9-20-10-16-22/h19-20H,5-18H2,1-4H3
InChIKeyJIFJXAKYOQUKQP-UHFFFAOYSA-N
XLogP0.06
TPSA76.69 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds14
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.73
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

trimethoxy(3-piperazin-1-ylpropyl)silane
CID 12841680
trimethoxy-[3-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]propyl]silane
CID 178023107
trimethoxy-[3-[16-(3-trimethoxysilylpropyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]propyl]silane
CID 102530971
ethoxy-dimethyl-(3-piperazin-1-ylpropyl)silane
CID 68897887
N-[dimethyl(3-piperazin-1-ylpropyl)silyl]-N-methylmethanamine
CID 174067282
trimethoxy(3-pyrazolidin-1-ylpropyl)silane
CID 18967958
dimethoxy(4-piperazin-1-ylbutyl)silane
CID 173068820
11-(4,7-dimethyl-1,4,7-triazonan-1-yl)undecyl-trimethoxysilane
CID 102100554
8-chlorooctyl(trimethoxy)silane;morpholine;trimethoxy(8-morpholin-4-yloctyl)silane
CID 165068627
aziridine;3-chloropropyl(trimethoxy)silane
CID 121233192
3-piperazin-1-ylpropan-1-ol;dihydrochloride
CID 22460998
1-[3-(3-methylazetidin-1-yl)propyl]piperazine
CID 79677275

Frequently Asked Questions

What is the IUPAC name of [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane?
The IUPAC name of [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane (CID 141466388) is [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane.
What is the SMILES notation for [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane?
The canonical SMILES for [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane is CO[Si](CCCN1CCNCC1)(OC)O[Si](CCCN1CCNCC1)(OC)OC.
What is the InChIKey of [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane?
The InChIKey is JIFJXAKYOQUKQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42N4O5Si2/c1-23-28(24-2,17-5-11-21-13-7-19-8-14-21)27-29(25-3,26-4)18-6-12-22-15-9-20-10-16-22/h19-20H,5-18H2,1-4H3.
What are the key properties of [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane?
[dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane has a molecular weight of 450.73 g/mol, XLogP of 0.06, 14 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethoxy(3-piperazin-1-ylpropyl)silyl]oxy-dimethoxy-(3-piperazin-1-ylpropyl)silane is sourced from PubChem (CID 141466388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).