triethyl(3-trimethylsilylpropyl)azanium iodide

C12H30INSi — CID 13141493

IUPACtriethyl(3-trimethylsilylpropyl)azanium iodide
SMILESCC[N+](CC)(CC)CCC[Si](C)(C)C.[I-]
InChIInChI=1S/C12H30NSi.HI/c1-7-13(8-2,9-3)11-10-12-14(4,5)6;/h7-12H2,1-6H3;1H/q+1;/p-1
InChIKeyVFMDRVLUFAKHBZ-UHFFFAOYSA-M
MW343.37 g/mol
LogP0.60
Rot. Bonds7

About triethyl(3-trimethylsilylpropyl)azanium iodide

triethyl(3-trimethylsilylpropyl)azanium iodide (PubChem CID 13141493) has the molecular formula C12H30INSi and a molecular weight of 343.37 g/mol. Its IUPAC name is triethyl(3-trimethylsilylpropyl)azanium iodide.

Molecular Properties

Compound Nametriethyl(3-trimethylsilylpropyl)azanium iodide
PubChem CID13141493
Molecular FormulaC12H30INSi
Molecular Weight343.37 g/mol
Exact Mass343.12
IUPAC Nametriethyl(3-trimethylsilylpropyl)azanium iodide
SMILESCC[N+](CC)(CC)CCC[Si](C)(C)C.[I-]
InChIInChI=1S/C12H30NSi.HI/c1-7-13(8-2,9-3)11-10-12-14(4,5)6;/h7-12H2,1-6H3;1H/q+1;/p-1
InChIKeyVFMDRVLUFAKHBZ-UHFFFAOYSA-M
XLogP0.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.37
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triethyl(3-trimethylsilylpropyl)azanium iodide?
The IUPAC name of triethyl(3-trimethylsilylpropyl)azanium iodide (CID 13141493) is triethyl(3-trimethylsilylpropyl)azanium iodide.
What is the SMILES notation for triethyl(3-trimethylsilylpropyl)azanium iodide?
The canonical SMILES for triethyl(3-trimethylsilylpropyl)azanium iodide is CC[N+](CC)(CC)CCC[Si](C)(C)C.[I-].
What is the InChIKey of triethyl(3-trimethylsilylpropyl)azanium iodide?
The InChIKey is VFMDRVLUFAKHBZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C12H30NSi.HI/c1-7-13(8-2,9-3)11-10-12-14(4,5)6;/h7-12H2,1-6H3;1H/q+1;/p-1.
What are the key properties of triethyl(3-trimethylsilylpropyl)azanium iodide?
triethyl(3-trimethylsilylpropyl)azanium iodide has a molecular weight of 343.37 g/mol, XLogP of 0.60, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(3-trimethylsilylpropyl)azanium iodide is sourced from PubChem (CID 13141493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).