2-ethenyl-2-trimethylsilyloxypent-4-enenitrile

C10H17NOSi — CID 12589757

IUPAC2-ethenyl-2-trimethylsilyloxypent-4-enenitrile
SMILESC=CCC(C#N)(C=C)O[Si](C)(C)C
InChIInChI=1S/C10H17NOSi/c1-6-8-10(7-2,9-11)12-13(3,4)5/h6-7H,1-2,8H2,3-5H3
InChIKeySZFOFQXFRHWJJS-UHFFFAOYSA-N
MW195.34 g/mol
LogP2.86
Rot. Bonds5

About 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile

2-ethenyl-2-trimethylsilyloxypent-4-enenitrile (PubChem CID 12589757) has the molecular formula C10H17NOSi and a molecular weight of 195.34 g/mol. Its IUPAC name is 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile.

Molecular Properties

Compound Name2-ethenyl-2-trimethylsilyloxypent-4-enenitrile
PubChem CID12589757
Molecular FormulaC10H17NOSi
Molecular Weight195.34 g/mol
Exact Mass195.11
IUPAC Name2-ethenyl-2-trimethylsilyloxypent-4-enenitrile
SMILESC=CCC(C#N)(C=C)O[Si](C)(C)C
InChIInChI=1S/C10H17NOSi/c1-6-8-10(7-2,9-11)12-13(3,4)5/h6-7H,1-2,8H2,3-5H3
InChIKeySZFOFQXFRHWJJS-UHFFFAOYSA-N
XLogP2.86
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.34
LogP ≤ 52.86
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'}

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Related Compounds

CID 13705584
CID 13705584
CID 134836227
CID 134836227
CID 134892538
CID 134892538
CID 135041625
CID 135041625
CID 10466887
CID 10466887
CID 12633136
CID 12633136
CID 12633140
CID 12633140
CID 101841857
CID 101841857
CID 102506641
CID 102506641
CID 102514204
CID 102514204

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile?
The IUPAC name of 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile (CID 12589757) is 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile.
What is the SMILES notation for 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile?
The canonical SMILES for 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile is C=CCC(C#N)(C=C)O[Si](C)(C)C.
What is the InChIKey of 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile?
The InChIKey is SZFOFQXFRHWJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NOSi/c1-6-8-10(7-2,9-11)12-13(3,4)5/h6-7H,1-2,8H2,3-5H3.
What are the key properties of 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile?
2-ethenyl-2-trimethylsilyloxypent-4-enenitrile has a molecular weight of 195.34 g/mol, XLogP of 2.86, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-2-trimethylsilyloxypent-4-enenitrile is sourced from PubChem (CID 12589757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).