N-ethyl-1-triethoxysilylpropan-2-amine

C11H27NO3Si — CID 19877448

IUPACN-ethyl-1-triethoxysilylpropan-2-amine
SMILESCCNC(C)C[Si](OCC)(OCC)OCC
InChIInChI=1S/C11H27NO3Si/c1-6-12-11(5)10-16(13-7-2,14-8-3)15-9-4/h11-12H,6-10H2,1-5H3
InChIKeyZGBURSPNNIJGEG-UHFFFAOYSA-N
MW249.43 g/mol
LogP2.03
Rot. Bonds10

About N-ethyl-1-triethoxysilylpropan-2-amine

N-ethyl-1-triethoxysilylpropan-2-amine (PubChem CID 19877448) has the molecular formula C11H27NO3Si and a molecular weight of 249.43 g/mol. Its IUPAC name is N-ethyl-1-triethoxysilylpropan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-triethoxysilylpropan-2-amine
PubChem CID19877448
Molecular FormulaC11H27NO3Si
Molecular Weight249.43 g/mol
Exact Mass249.18
IUPAC NameN-ethyl-1-triethoxysilylpropan-2-amine
SMILESCCNC(C)C[Si](OCC)(OCC)OCC
InChIInChI=1S/C11H27NO3Si/c1-6-12-11(5)10-16(13-7-2,14-8-3)15-9-4/h11-12H,6-10H2,1-5H3
InChIKeyZGBURSPNNIJGEG-UHFFFAOYSA-N
XLogP2.03
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.43
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 N-ethyl-1-triethoxysilylpropan-2-amine?
The IUPAC name of N-ethyl-1-triethoxysilylpropan-2-amine (CID 19877448) is N-ethyl-1-triethoxysilylpropan-2-amine.
What is the SMILES notation for N-ethyl-1-triethoxysilylpropan-2-amine?
The canonical SMILES for N-ethyl-1-triethoxysilylpropan-2-amine is CCNC(C)C[Si](OCC)(OCC)OCC.
What is the InChIKey of N-ethyl-1-triethoxysilylpropan-2-amine?
The InChIKey is ZGBURSPNNIJGEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27NO3Si/c1-6-12-11(5)10-16(13-7-2,14-8-3)15-9-4/h11-12H,6-10H2,1-5H3.
What are the key properties of N-ethyl-1-triethoxysilylpropan-2-amine?
N-ethyl-1-triethoxysilylpropan-2-amine has a molecular weight of 249.43 g/mol, XLogP of 2.03, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-triethoxysilylpropan-2-amine is sourced from PubChem (CID 19877448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).