3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine

C10H25NO3Si — CID 173018301

IUPAC3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine
SMILESCCNCC(C)C[SiH2]OC(C)(OC)OC
InChIInChI=1S/C10H25NO3Si/c1-6-11-7-9(2)8-15-14-10(3,12-4)13-5/h9,11H,6-8,15H2,1-5H3
InChIKeyROPDFLXSNYBQIN-UHFFFAOYSA-N
MW235.40 g/mol
LogP0.72
Rot. Bonds9

About 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine

3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine (PubChem CID 173018301) has the molecular formula C10H25NO3Si and a molecular weight of 235.40 g/mol. Its IUPAC name is 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine
PubChem CID173018301
Molecular FormulaC10H25NO3Si
Molecular Weight235.40 g/mol
Exact Mass235.16
IUPAC Name3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine
SMILESCCNCC(C)C[SiH2]OC(C)(OC)OC
InChIInChI=1S/C10H25NO3Si/c1-6-11-7-9(2)8-15-14-10(3,12-4)13-5/h9,11H,6-8,15H2,1-5H3
InChIKeyROPDFLXSNYBQIN-UHFFFAOYSA-N
XLogP0.72
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.40
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine?
The IUPAC name of 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine (CID 173018301) is 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine.
What is the SMILES notation for 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine?
The canonical SMILES for 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine is CCNCC(C)C[SiH2]OC(C)(OC)OC.
What is the InChIKey of 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine?
The InChIKey is ROPDFLXSNYBQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NO3Si/c1-6-11-7-9(2)8-15-14-10(3,12-4)13-5/h9,11H,6-8,15H2,1-5H3.
What are the key properties of 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine?
3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine has a molecular weight of 235.40 g/mol, XLogP of 0.72, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,1-dimethoxyethoxysilyl)-N-ethyl-2-methylpropan-1-amine is sourced from PubChem (CID 173018301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).