hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane

C7H16N2O2Si — CID 58776150

IUPAChydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane
SMILESCN1CCN(CCC[Si](=O)O)C1
InChIInChI=1S/C7H16N2O2Si/c1-8-4-5-9(7-8)3-2-6-12(10)11/h10H,2-7H2,1H3
InChIKeyNNTKZBHVFLROAC-UHFFFAOYSA-N
MW188.30 g/mol
LogP-0.51
Rot. Bonds4

About hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane

hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane (PubChem CID 58776150) has the molecular formula C7H16N2O2Si and a molecular weight of 188.30 g/mol. Its IUPAC name is hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane.

Molecular Properties

Compound Namehydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane
PubChem CID58776150
Molecular FormulaC7H16N2O2Si
Molecular Weight188.30 g/mol
Exact Mass188.10
IUPAC Namehydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane
SMILESCN1CCN(CCC[Si](=O)O)C1
InChIInChI=1S/C7H16N2O2Si/c1-8-4-5-9(7-8)3-2-6-12(10)11/h10H,2-7H2,1H3
InChIKeyNNTKZBHVFLROAC-UHFFFAOYSA-N
XLogP-0.51
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.30
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane?
The IUPAC name of hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane (CID 58776150) is hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane.
What is the SMILES notation for hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane?
The canonical SMILES for hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane is CN1CCN(CCC[Si](=O)O)C1.
What is the InChIKey of hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane?
The InChIKey is NNTKZBHVFLROAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2Si/c1-8-4-5-9(7-8)3-2-6-12(10)11/h10H,2-7H2,1H3.
What are the key properties of hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane?
hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane has a molecular weight of 188.30 g/mol, XLogP of -0.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-[3-(3-methylimidazolidin-1-yl)propyl]-oxosilane is sourced from PubChem (CID 58776150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).