3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane

C15H34N2O2Si — CID 59927470

IUPAC3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane
SMILESCCCCN1CCN(CCC[Si](C)(OCC)OCC)C1
InChIInChI=1S/C15H34N2O2Si/c1-5-8-10-16-12-13-17(15-16)11-9-14-20(4,18-6-2)19-7-3/h5-15H2,1-4H3
InChIKeyIRTFNHFBXYQXNJ-UHFFFAOYSA-N
MW302.54 g/mol
LogP2.90
Rot. Bonds11

About 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane

3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane (PubChem CID 59927470) has the molecular formula C15H34N2O2Si and a molecular weight of 302.54 g/mol. Its IUPAC name is 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane.

Molecular Properties

Compound Name3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane
PubChem CID59927470
Molecular FormulaC15H34N2O2Si
Molecular Weight302.54 g/mol
Exact Mass302.24
IUPAC Name3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane
SMILESCCCCN1CCN(CCC[Si](C)(OCC)OCC)C1
InChIInChI=1S/C15H34N2O2Si/c1-5-8-10-16-12-13-17(15-16)11-9-14-20(4,18-6-2)19-7-3/h5-15H2,1-4H3
InChIKeyIRTFNHFBXYQXNJ-UHFFFAOYSA-N
XLogP2.90
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.54
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane
CID 153419971
1-butyl-3-methyl-1,3-diazetidine
CID 54539532
dimethoxy-methyl-[3-(3-methylimidazolidin-1-yl)propyl]silane
CID 135012420
3-(4-butylpiperazin-1-yl)propyl-(4-fluorophenyl)-dimethylsilane
CID 67899963
triethoxy-[3-[3-[3-(oxiran-2-ylmethoxy)propyl]imidazolidin-1-yl]propyl]silane
CID 140960756
1-[3-[diethoxy(methyl)silyl]propyl]-N-(2-trimethylsilylethyl)pyrrolidin-3-amine
CID 66603163
3-(3-ethenylimidazolidin-1-yl)propyl-triethoxysilane
CID 123281277
1-butyl-3-methylimidazolidine;tetrachloroiron(1-)
CID 159576929
diethoxy-methyl-[2-[4-tri(propan-2-yl)silylpiperazin-1-yl]ethyl]silane
CID 23150092
ethoxy-methyl-octyl-propan-2-yloxysilane
CID 175038920
1,3,5-tri(hexacosyl)-1,3,5-triazinane
CID 175381685
N-butyl-N-[2-[4-[8-[ethoxy(dimethyl)silyl]octyl]piperazin-1-yl]ethyl]butan-1-amine
CID 178023200

Frequently Asked Questions

What is the IUPAC name of 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane?
The IUPAC name of 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane (CID 59927470) is 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane.
What is the SMILES notation for 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane?
The canonical SMILES for 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane is CCCCN1CCN(CCC[Si](C)(OCC)OCC)C1.
What is the InChIKey of 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane?
The InChIKey is IRTFNHFBXYQXNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2O2Si/c1-5-8-10-16-12-13-17(15-16)11-9-14-20(4,18-6-2)19-7-3/h5-15H2,1-4H3.
What are the key properties of 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane?
3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane has a molecular weight of 302.54 g/mol, XLogP of 2.90, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane is sourced from PubChem (CID 59927470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).