3-(2-trimethylsilylethoxy)propanenitrile

C8H17NOSi — CID 175133125

IUPAC3-(2-trimethylsilylethoxy)propanenitrile
SMILESC[Si](C)(C)CCOCCC#N
InChIInChI=1S/C8H17NOSi/c1-11(2,3)8-7-10-6-4-5-9/h4,6-8H2,1-3H3
InChIKeyGWEOSVZGRSVUNV-UHFFFAOYSA-N
MW171.32 g/mol
LogP2.25
Rot. Bonds5

About 3-(2-trimethylsilylethoxy)propanenitrile

3-(2-trimethylsilylethoxy)propanenitrile (PubChem CID 175133125) has the molecular formula C8H17NOSi and a molecular weight of 171.32 g/mol. Its IUPAC name is 3-(2-trimethylsilylethoxy)propanenitrile.

Molecular Properties

Compound Name3-(2-trimethylsilylethoxy)propanenitrile
PubChem CID175133125
Molecular FormulaC8H17NOSi
Molecular Weight171.32 g/mol
Exact Mass171.11
IUPAC Name3-(2-trimethylsilylethoxy)propanenitrile
SMILESC[Si](C)(C)CCOCCC#N
InChIInChI=1S/C8H17NOSi/c1-11(2,3)8-7-10-6-4-5-9/h4,6-8H2,1-3H3
InChIKeyGWEOSVZGRSVUNV-UHFFFAOYSA-N
XLogP2.25
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.32
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[2-[bromo(diethoxy)silyl]ethoxy]propanenitrile
CID 87213817
3-[2-[2-[2-(2-cyanoethoxy)ethoxymethoxy]ethoxymethoxy]ethoxy]propanenitrile
CID 151275278
2-(2-trimethylsilylethoxy)ethanamine
CID 158645142
3-(4-propoxybutoxy)propanenitrile
CID 146175563
3-[2-(2-cyanoethoxymethyl)-2-ethylbutoxy]propanenitrile
CID 58461553
3-[2-(2-methylpropoxy)ethoxy]propanenitrile
CID 106447606
6-(2-cyanoethoxy)hexanenitrile
CID 142730413
2-(fluoromethoxy)ethyl-trimethylsilane
CID 175695577
3-methoxypropanenitrile
CID 161061289
3-[3-[3-[3-[3-[3-[bis[3-[3-[bis[3-(2-cyanoethoxy)propyl]amino]propoxy]propyl]amino]propoxy]propyl-[3-[3-[bis[3-(2-cyanoethoxy)propyl]amino]propoxy]propyl]amino]propoxy]propyl-[3-(2-cyanoethoxy)propyl]amino]propoxy]propanenitrile
CID 11320859
3-[2-(2-cyanoethoxy)ethylamino]propanenitrile
CID 13446506
N,N-dimethyl-1-(2-trimethylsilylethoxy)methanamine
CID 21339561

Frequently Asked Questions

What is the IUPAC name of 3-(2-trimethylsilylethoxy)propanenitrile?
The IUPAC name of 3-(2-trimethylsilylethoxy)propanenitrile (CID 175133125) is 3-(2-trimethylsilylethoxy)propanenitrile.
What is the SMILES notation for 3-(2-trimethylsilylethoxy)propanenitrile?
The canonical SMILES for 3-(2-trimethylsilylethoxy)propanenitrile is C[Si](C)(C)CCOCCC#N.
What is the InChIKey of 3-(2-trimethylsilylethoxy)propanenitrile?
The InChIKey is GWEOSVZGRSVUNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NOSi/c1-11(2,3)8-7-10-6-4-5-9/h4,6-8H2,1-3H3.
What are the key properties of 3-(2-trimethylsilylethoxy)propanenitrile?
3-(2-trimethylsilylethoxy)propanenitrile has a molecular weight of 171.32 g/mol, XLogP of 2.25, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-trimethylsilylethoxy)propanenitrile is sourced from PubChem (CID 175133125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).