2-(2-dimethoxysilyloxan-2-yl)ethanamine

C9H21NO3Si — CID 175137112

IUPAC2-(2-dimethoxysilyloxan-2-yl)ethanamine
SMILESCO[SiH](OC)C1(CCN)CCCCO1
InChIInChI=1S/C9H21NO3Si/c1-11-14(12-2)9(6-7-10)5-3-4-8-13-9/h14H,3-8,10H2,1-2H3
InChIKeyWQKJBTRATVWYMI-UHFFFAOYSA-N
MW219.36 g/mol
LogP0.33
Rot. Bonds5

About 2-(2-dimethoxysilyloxan-2-yl)ethanamine

2-(2-dimethoxysilyloxan-2-yl)ethanamine (PubChem CID 175137112) has the molecular formula C9H21NO3Si and a molecular weight of 219.36 g/mol. Its IUPAC name is 2-(2-dimethoxysilyloxan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(2-dimethoxysilyloxan-2-yl)ethanamine
PubChem CID175137112
Molecular FormulaC9H21NO3Si
Molecular Weight219.36 g/mol
Exact Mass219.13
IUPAC Name2-(2-dimethoxysilyloxan-2-yl)ethanamine
SMILESCO[SiH](OC)C1(CCN)CCCCO1
InChIInChI=1S/C9H21NO3Si/c1-11-14(12-2)9(6-7-10)5-3-4-8-13-9/h14H,3-8,10H2,1-2H3
InChIKeyWQKJBTRATVWYMI-UHFFFAOYSA-N
XLogP0.33
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.36
LogP ≤ 50.33
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 2-(2-dimethoxysilyloxan-2-yl)ethanamine?
The IUPAC name of 2-(2-dimethoxysilyloxan-2-yl)ethanamine (CID 175137112) is 2-(2-dimethoxysilyloxan-2-yl)ethanamine.
What is the SMILES notation for 2-(2-dimethoxysilyloxan-2-yl)ethanamine?
The canonical SMILES for 2-(2-dimethoxysilyloxan-2-yl)ethanamine is CO[SiH](OC)C1(CCN)CCCCO1.
What is the InChIKey of 2-(2-dimethoxysilyloxan-2-yl)ethanamine?
The InChIKey is WQKJBTRATVWYMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO3Si/c1-11-14(12-2)9(6-7-10)5-3-4-8-13-9/h14H,3-8,10H2,1-2H3.
What are the key properties of 2-(2-dimethoxysilyloxan-2-yl)ethanamine?
2-(2-dimethoxysilyloxan-2-yl)ethanamine has a molecular weight of 219.36 g/mol, XLogP of 0.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-dimethoxysilyloxan-2-yl)ethanamine is sourced from PubChem (CID 175137112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).