3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane

C9H23N2O3Si+ — CID 134961671

IUPAC3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane
SMILESCO[Si](CCC[NH+]1CCNC1)(OC)OC
InChIInChI=1S/C9H22N2O3Si/c1-12-15(13-2,14-3)8-4-6-11-7-5-10-9-11/h10H,4-9H2,1-3H3/p+1
InChIKeyOOYHIEQOORGCHO-UHFFFAOYSA-O
MW235.38 g/mol
LogP-1.30
Rot. Bonds7

About 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane

3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane (PubChem CID 134961671) has the molecular formula C9H23N2O3Si+ and a molecular weight of 235.38 g/mol. Its IUPAC name is 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane.

Molecular Properties

Compound Name3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane
PubChem CID134961671
Molecular FormulaC9H23N2O3Si+
Molecular Weight235.38 g/mol
Exact Mass235.15
IUPAC Name3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane
SMILESCO[Si](CCC[NH+]1CCNC1)(OC)OC
InChIInChI=1S/C9H22N2O3Si/c1-12-15(13-2,14-3)8-4-6-11-7-5-10-9-11/h10H,4-9H2,1-3H3/p+1
InChIKeyOOYHIEQOORGCHO-UHFFFAOYSA-O
XLogP-1.30
TPSA44.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 5-1.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane?
The IUPAC name of 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane (CID 134961671) is 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane.
What is the SMILES notation for 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane?
The canonical SMILES for 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane is CO[Si](CCC[NH+]1CCNC1)(OC)OC.
What is the InChIKey of 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane?
The InChIKey is OOYHIEQOORGCHO-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H22N2O3Si/c1-12-15(13-2,14-3)8-4-6-11-7-5-10-9-11/h10H,4-9H2,1-3H3/p+1.
What are the key properties of 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane?
3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane has a molecular weight of 235.38 g/mol, XLogP of -1.30, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazolidin-1-ium-1-ylpropyl(trimethoxy)silane is sourced from PubChem (CID 134961671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).