trimethoxy(3-piperazin-1-ylpropyl)silane

C10H24N2O3Si — CID 12841680

IUPACtrimethoxy(3-piperazin-1-ylpropyl)silane
SMILESCO[Si](CCCN1CCNCC1)(OC)OC
InChIInChI=1S/C10H24N2O3Si/c1-13-16(14-2,15-3)10-4-7-12-8-5-11-6-9-12/h11H,4-10H2,1-3H3
InChIKeyHXYMWKLNCJPAKW-UHFFFAOYSA-N
MW248.40 g/mol
LogP0.16
Rot. Bonds7

About trimethoxy(3-piperazin-1-ylpropyl)silane

trimethoxy(3-piperazin-1-ylpropyl)silane (PubChem CID 12841680) has the molecular formula C10H24N2O3Si and a molecular weight of 248.40 g/mol. Its IUPAC name is trimethoxy(3-piperazin-1-ylpropyl)silane.

Molecular Properties

Compound Nametrimethoxy(3-piperazin-1-ylpropyl)silane
PubChem CID12841680
Molecular FormulaC10H24N2O3Si
Molecular Weight248.40 g/mol
Exact Mass248.16
IUPAC Nametrimethoxy(3-piperazin-1-ylpropyl)silane
SMILESCO[Si](CCCN1CCNCC1)(OC)OC
InChIInChI=1S/C10H24N2O3Si/c1-13-16(14-2,15-3)10-4-7-12-8-5-11-6-9-12/h11H,4-10H2,1-3H3
InChIKeyHXYMWKLNCJPAKW-UHFFFAOYSA-N
XLogP0.16
TPSA42.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.40
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethoxy(3-piperazin-1-ylpropyl)silane?
The IUPAC name of trimethoxy(3-piperazin-1-ylpropyl)silane (CID 12841680) is trimethoxy(3-piperazin-1-ylpropyl)silane.
What is the SMILES notation for trimethoxy(3-piperazin-1-ylpropyl)silane?
The canonical SMILES for trimethoxy(3-piperazin-1-ylpropyl)silane is CO[Si](CCCN1CCNCC1)(OC)OC.
What is the InChIKey of trimethoxy(3-piperazin-1-ylpropyl)silane?
The InChIKey is HXYMWKLNCJPAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3Si/c1-13-16(14-2,15-3)10-4-7-12-8-5-11-6-9-12/h11H,4-10H2,1-3H3.
What are the key properties of trimethoxy(3-piperazin-1-ylpropyl)silane?
trimethoxy(3-piperazin-1-ylpropyl)silane has a molecular weight of 248.40 g/mol, XLogP of 0.16, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(3-piperazin-1-ylpropyl)silane is sourced from PubChem (CID 12841680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).