3-trimethylsilyloxypent-4-enenitrile

C8H15NOSi — CID 11137546

IUPAC3-trimethylsilyloxypent-4-enenitrile
SMILESC=CC(CC#N)O[Si](C)(C)C
InChIInChI=1S/C8H15NOSi/c1-5-8(6-7-9)10-11(2,3)4/h5,8H,1,6H2,2-4H3
InChIKeySRTCIRBFBBCIIB-UHFFFAOYSA-N
MW169.30 g/mol
LogP2.31
Rot. Bonds4

About 3-trimethylsilyloxypent-4-enenitrile

3-trimethylsilyloxypent-4-enenitrile (PubChem CID 11137546) has the molecular formula C8H15NOSi and a molecular weight of 169.30 g/mol. Its IUPAC name is 3-trimethylsilyloxypent-4-enenitrile.

Molecular Properties

Compound Name3-trimethylsilyloxypent-4-enenitrile
PubChem CID11137546
Molecular FormulaC8H15NOSi
Molecular Weight169.30 g/mol
Exact Mass169.09
IUPAC Name3-trimethylsilyloxypent-4-enenitrile
SMILESC=CC(CC#N)O[Si](C)(C)C
InChIInChI=1S/C8H15NOSi/c1-5-8(6-7-9)10-11(2,3)4/h5,8H,1,6H2,2-4H3
InChIKeySRTCIRBFBBCIIB-UHFFFAOYSA-N
XLogP2.31
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.30
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-trimethylsilyloxypent-4-enenitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-trimethylsilyloxypent-4-enenitrile?
The IUPAC name of 3-trimethylsilyloxypent-4-enenitrile (CID 11137546) is 3-trimethylsilyloxypent-4-enenitrile.
What is the SMILES notation for 3-trimethylsilyloxypent-4-enenitrile?
The canonical SMILES for 3-trimethylsilyloxypent-4-enenitrile is C=CC(CC#N)O[Si](C)(C)C.
What is the InChIKey of 3-trimethylsilyloxypent-4-enenitrile?
The InChIKey is SRTCIRBFBBCIIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NOSi/c1-5-8(6-7-9)10-11(2,3)4/h5,8H,1,6H2,2-4H3.
What are the key properties of 3-trimethylsilyloxypent-4-enenitrile?
3-trimethylsilyloxypent-4-enenitrile has a molecular weight of 169.30 g/mol, XLogP of 2.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethylsilyloxypent-4-enenitrile is sourced from PubChem (CID 11137546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).