triethylsilyl cyanate

C7H15NOSi — CID 19049697

IUPACtriethylsilyl cyanate
SMILESCC[Si](CC)(CC)OC#N
InChIInChI=1S/C7H15NOSi/c1-4-10(5-2,6-3)9-7-8/h4-6H2,1-3H3
InChIKeyFHQFGCNGDLIARU-UHFFFAOYSA-N
MW157.29 g/mol
LogP2.49
Rot. Bonds4

About triethylsilyl cyanate

triethylsilyl cyanate (PubChem CID 19049697) has the molecular formula C7H15NOSi and a molecular weight of 157.29 g/mol. Its IUPAC name is triethylsilyl cyanate.

Molecular Properties

Compound Nametriethylsilyl cyanate
PubChem CID19049697
Molecular FormulaC7H15NOSi
Molecular Weight157.29 g/mol
Exact Mass157.09
IUPAC Nametriethylsilyl cyanate
SMILESCC[Si](CC)(CC)OC#N
InChIInChI=1S/C7H15NOSi/c1-4-10(5-2,6-3)9-7-8/h4-6H2,1-3H3
InChIKeyFHQFGCNGDLIARU-UHFFFAOYSA-N
XLogP2.49
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.29
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyanate_/aminonitrile_/thiocyanate', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze triethylsilyl cyanate 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 triethylsilyl cyanate?
The IUPAC name of triethylsilyl cyanate (CID 19049697) is triethylsilyl cyanate.
What is the SMILES notation for triethylsilyl cyanate?
The canonical SMILES for triethylsilyl cyanate is CC[Si](CC)(CC)OC#N.
What is the InChIKey of triethylsilyl cyanate?
The InChIKey is FHQFGCNGDLIARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NOSi/c1-4-10(5-2,6-3)9-7-8/h4-6H2,1-3H3.
What are the key properties of triethylsilyl cyanate?
triethylsilyl cyanate has a molecular weight of 157.29 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethylsilyl cyanate is sourced from PubChem (CID 19049697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).