triethoxy(3-imidazol-1-ylpropyl)silane

C12H24N2O3Si — CID 3017411

IUPACtriethoxy(3-imidazol-1-ylpropyl)silane
SMILESCCO[Si](CCCn1ccnc1)(OCC)OCC
InChIInChI=1S/C12H24N2O3Si/c1-4-15-18(16-5-2,17-6-3)11-7-9-14-10-8-13-12-14/h8,10,12H,4-7,9,11H2,1-3H3
InChIKeyURLXRQIVAJGITA-UHFFFAOYSA-N
MW272.42 g/mol
LogP2.32
Rot. Bonds10

About triethoxy(3-imidazol-1-ylpropyl)silane

triethoxy(3-imidazol-1-ylpropyl)silane (PubChem CID 3017411) has the molecular formula C12H24N2O3Si and a molecular weight of 272.42 g/mol. Its IUPAC name is triethoxy(3-imidazol-1-ylpropyl)silane.

Molecular Properties

Compound Nametriethoxy(3-imidazol-1-ylpropyl)silane
PubChem CID3017411
Molecular FormulaC12H24N2O3Si
Molecular Weight272.42 g/mol
Exact Mass272.16
IUPAC Nametriethoxy(3-imidazol-1-ylpropyl)silane
SMILESCCO[Si](CCCn1ccnc1)(OCC)OCC
InChIInChI=1S/C12H24N2O3Si/c1-4-15-18(16-5-2,17-6-3)11-7-9-14-10-8-13-12-14/h8,10,12H,4-7,9,11H2,1-3H3
InChIKeyURLXRQIVAJGITA-UHFFFAOYSA-N
XLogP2.32
TPSA45.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.42
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N,N-bis[3-[diethoxy(ethyl)silyl]propyl]-3-imidazol-1-ylpropan-1-amine
CID 157021381
1-(13-ethoxytridecyl)imidazole
CID 145255635
sodium;1-butylimidazole;bromide
CID 175480877
1-(14-imidazol-1-yltetradecyl)imidazole;hydrochloride
CID 57391442
1-nonylimidazole;hydrobromide
CID 175434544
bis(1-butylimidazole);heptane;dihydrobromide
CID 175107148
triethoxy-[3-(3-methylimidazol-3-ium-1-yl)propyl]silane
CID 15500386
3-imidazol-1-ylpropan-1-amine;hydrochloride
CID 19864194
1-butylimidazole;hydron;hexafluorophosphate
CID 174546653
1-butylimidazole;1-ethylimidazole;1-propylimidazole
CID 143151765
N-(3-imidazol-1-ylpropyl)ethanesulfonamide
CID 19685069
2-ethyl-2-(3-imidazol-1-ylpropoxy)butan-1-amine
CID 65050699

Frequently Asked Questions

What is the IUPAC name of triethoxy(3-imidazol-1-ylpropyl)silane?
The IUPAC name of triethoxy(3-imidazol-1-ylpropyl)silane (CID 3017411) is triethoxy(3-imidazol-1-ylpropyl)silane.
What is the SMILES notation for triethoxy(3-imidazol-1-ylpropyl)silane?
The canonical SMILES for triethoxy(3-imidazol-1-ylpropyl)silane is CCO[Si](CCCn1ccnc1)(OCC)OCC.
What is the InChIKey of triethoxy(3-imidazol-1-ylpropyl)silane?
The InChIKey is URLXRQIVAJGITA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3Si/c1-4-15-18(16-5-2,17-6-3)11-7-9-14-10-8-13-12-14/h8,10,12H,4-7,9,11H2,1-3H3.
What are the key properties of triethoxy(3-imidazol-1-ylpropyl)silane?
triethoxy(3-imidazol-1-ylpropyl)silane has a molecular weight of 272.42 g/mol, XLogP of 2.32, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(3-imidazol-1-ylpropyl)silane is sourced from PubChem (CID 3017411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).