2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine

C11H27NO4Si — CID 87148947

IUPAC2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine
SMILESCCO[Si](CCCOC(C)CNC)(OC)OC
InChIInChI=1S/C11H27NO4Si/c1-6-16-17(13-4,14-5)9-7-8-15-11(2)10-12-3/h11-12H,6-10H2,1-5H3
InChIKeyPELQJRQRKGDYBK-UHFFFAOYSA-N
MW265.43 g/mol
LogP1.27
Rot. Bonds11

About 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine

2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine (PubChem CID 87148947) has the molecular formula C11H27NO4Si and a molecular weight of 265.43 g/mol. Its IUPAC name is 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine
PubChem CID87148947
Molecular FormulaC11H27NO4Si
Molecular Weight265.43 g/mol
Exact Mass265.17
IUPAC Name2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine
SMILESCCO[Si](CCCOC(C)CNC)(OC)OC
InChIInChI=1S/C11H27NO4Si/c1-6-16-17(13-4,14-5)9-7-8-15-11(2)10-12-3/h11-12H,6-10H2,1-5H3
InChIKeyPELQJRQRKGDYBK-UHFFFAOYSA-N
XLogP1.27
TPSA48.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine?
The IUPAC name of 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine (CID 87148947) is 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine.
What is the SMILES notation for 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine?
The canonical SMILES for 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine is CCO[Si](CCCOC(C)CNC)(OC)OC.
What is the InChIKey of 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine?
The InChIKey is PELQJRQRKGDYBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27NO4Si/c1-6-16-17(13-4,14-5)9-7-8-15-11(2)10-12-3/h11-12H,6-10H2,1-5H3.
What are the key properties of 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine?
2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine has a molecular weight of 265.43 g/mol, XLogP of 1.27, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[ethoxy(dimethoxy)silyl]propoxy]-N-methylpropan-1-amine is sourced from PubChem (CID 87148947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).