1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane

C8H22N2O3Si — CID 173167528

IUPAC1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane
SMILESCC(N)C1(C)CN1.CO[SiH](OC)OC
InChIInChI=1S/C5H12N2.C3H10O3Si/c1-4(6)5(2)3-7-5;1-4-7(5-2)6-3/h4,7H,3,6H2,1-2H3;7H,1-3H3
InChIKeyVQALEOHQLKTDAJ-UHFFFAOYSA-N
MW222.36 g/mol
LogP-0.66
Rot. Bonds4

About 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane

1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane (PubChem CID 173167528) has the molecular formula C8H22N2O3Si and a molecular weight of 222.36 g/mol. Its IUPAC name is 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane.

Molecular Properties

Compound Name1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane
PubChem CID173167528
Molecular FormulaC8H22N2O3Si
Molecular Weight222.36 g/mol
Exact Mass222.14
IUPAC Name1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane
SMILESCC(N)C1(C)CN1.CO[SiH](OC)OC
InChIInChI=1S/C5H12N2.C3H10O3Si/c1-4(6)5(2)3-7-5;1-4-7(5-2)6-3/h4,7H,3,6H2,1-2H3;7H,1-3H3
InChIKeyVQALEOHQLKTDAJ-UHFFFAOYSA-N
XLogP-0.66
TPSA75.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane?
The IUPAC name of 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane (CID 173167528) is 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane.
What is the SMILES notation for 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane?
The canonical SMILES for 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane is CC(N)C1(C)CN1.CO[SiH](OC)OC.
What is the InChIKey of 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane?
The InChIKey is VQALEOHQLKTDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2.C3H10O3Si/c1-4(6)5(2)3-7-5;1-4-7(5-2)6-3/h4,7H,3,6H2,1-2H3;7H,1-3H3.
What are the key properties of 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane?
1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane has a molecular weight of 222.36 g/mol, XLogP of -0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylaziridin-2-yl)ethanamine;trimethoxysilane is sourced from PubChem (CID 173167528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).