5-silylpentanenitrile

C5H11NSi — CID 173242016

IUPAC5-silylpentanenitrile
SMILESN#CCCCC[SiH3]
InChIInChI=1S/C5H11NSi/c6-4-2-1-3-5-7/h1-3,5H2,7H3
InChIKeyFEJJIEIWBVGVBJ-UHFFFAOYSA-N
MW113.24 g/mol
LogP0.46
Rot. Bonds3

About 5-silylpentanenitrile

5-silylpentanenitrile (PubChem CID 173242016) has the molecular formula C5H11NSi and a molecular weight of 113.24 g/mol. Its IUPAC name is 5-silylpentanenitrile.

Molecular Properties

Compound Name5-silylpentanenitrile
PubChem CID173242016
Molecular FormulaC5H11NSi
Molecular Weight113.24 g/mol
Exact Mass113.07
IUPAC Name5-silylpentanenitrile
SMILESN#CCCCC[SiH3]
InChIInChI=1S/C5H11NSi/c6-4-2-1-3-5-7/h1-3,5H2,7H3
InChIKeyFEJJIEIWBVGVBJ-UHFFFAOYSA-N
XLogP0.46
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.24
LogP ≤ 50.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

12-silyldodecanenitrile
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henicosanedinitrile
CID 87345062
4-bromobutanenitrile;5-bromopentanenitrile
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octadecanenitrile
CID 12532
hexadeca-6,8,10-triynedinitrile
CID 171119204
undecanenitrile
CID 16722
6-silylhexylsilane
CID 123693844
6-methylheptanenitrile
CID 22036153
3-(cyanomethyl)octanedinitrile
CID 122418868
6,6-diaminohexanenitrile
CID 19597239
ethane;5-hydroxypentanenitrile
CID 144859936
pentane-1,1,1,5-tetracarbonitrile
CID 175541123

Frequently Asked Questions

What is the IUPAC name of 5-silylpentanenitrile?
The IUPAC name of 5-silylpentanenitrile (CID 173242016) is 5-silylpentanenitrile.
What is the SMILES notation for 5-silylpentanenitrile?
The canonical SMILES for 5-silylpentanenitrile is N#CCCCC[SiH3].
What is the InChIKey of 5-silylpentanenitrile?
The InChIKey is FEJJIEIWBVGVBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NSi/c6-4-2-1-3-5-7/h1-3,5H2,7H3.
What are the key properties of 5-silylpentanenitrile?
5-silylpentanenitrile has a molecular weight of 113.24 g/mol, XLogP of 0.46, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-silylpentanenitrile is sourced from PubChem (CID 173242016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).