dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane

C10H21N2O2Si+ — CID 122211058

IUPACdimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane
SMILESCO[Si](C)(CCCn1cc[n+](C)c1)OC
InChIInChI=1S/C10H21N2O2Si/c1-11-7-8-12(10-11)6-5-9-15(4,13-2)14-3/h7-8,10H,5-6,9H2,1-4H3/q+1
InChIKeyZLXUBBAPYPCOAT-UHFFFAOYSA-N
MW229.38 g/mol
LogP1.07
Rot. Bonds6

About dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane

dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane (PubChem CID 122211058) has the molecular formula C10H21N2O2Si+ and a molecular weight of 229.38 g/mol. Its IUPAC name is dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane.

Molecular Properties

Compound Namedimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane
PubChem CID122211058
Molecular FormulaC10H21N2O2Si+
Molecular Weight229.38 g/mol
Exact Mass229.14
IUPAC Namedimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane
SMILESCO[Si](C)(CCCn1cc[n+](C)c1)OC
InChIInChI=1S/C10H21N2O2Si/c1-11-7-8-12(10-11)6-5-9-15(4,13-2)14-3/h7-8,10H,5-6,9H2,1-4H3/q+1
InChIKeyZLXUBBAPYPCOAT-UHFFFAOYSA-N
XLogP1.07
TPSA27.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.38
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

triethoxy-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane
CID 15500386
1-methyl-3-[15-(3-methylimidazol-3-ium-1-yl)pentadecyl]imidazol-1-ium dichloride
CID 71525194
1-methyl-3-[10-(3-methylimidazol-3-ium-1-yl)decyl]imidazol-1-ium diiodide
CID 46185650
1-methyl-3-[8-(3-methylimidazol-3-ium-1-yl)octyl]imidazol-1-ium;hydrobromide
CID 135325512
1-butyl-3-methylimidazol-3-ium;tetrahydrate
CID 175081123
3-(3-methylimidazol-3-ium-1-yl)propan-1-ol hydroxide
CID 86606382
1-methyl-3-pentylimidazol-1-ium iodide
CID 11403236
1-butyl-3-methylimidazol-3-ium;chloroplatinum
CID 175008486
1-heptyl-3-methylimidazol-3-ium chloride
CID 87431779
1-methyl-3-(4,4,4-trideuteriobutyl)imidazol-1-ium
CID 54589982
1-butyl-3-methylimidazol-3-ium;molecular bromine;bromide
CID 11245926
trimethyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]azanium
CID 177433045

Frequently Asked Questions

What is the IUPAC name of dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane?
The IUPAC name of dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane (CID 122211058) is dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane.
What is the SMILES notation for dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane?
The canonical SMILES for dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane is CO[Si](C)(CCCn1cc[n+](C)c1)OC.
What is the InChIKey of dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane?
The InChIKey is ZLXUBBAPYPCOAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N2O2Si/c1-11-7-8-12(10-11)6-5-9-15(4,13-2)14-3/h7-8,10H,5-6,9H2,1-4H3/q+1.
What are the key properties of dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane?
dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane has a molecular weight of 229.38 g/mol, XLogP of 1.07, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-methyl-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane is sourced from PubChem (CID 122211058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).