(1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium

C11H25NO3PSi2+ — CID 23264770

IUPAC(1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium
SMILESCC(C)C(C#N)(O[Si](C)(C)C)[P+](=O)O[Si](C)(C)C
InChIInChI=1S/C11H25NO3PSi2/c1-10(2)11(9-12,14-17(3,4)5)16(13)15-18(6,7)8/h10H,1-8H3/q+1
InChIKeyGMYUVXMGAFODGQ-UHFFFAOYSA-N
MW306.47 g/mol
LogP4.31
Rot. Bonds6

About (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium

(1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium (PubChem CID 23264770) has the molecular formula C11H25NO3PSi2+ and a molecular weight of 306.47 g/mol. Its IUPAC name is (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium.

Molecular Properties

Compound Name(1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium
PubChem CID23264770
Molecular FormulaC11H25NO3PSi2+
Molecular Weight306.47 g/mol
Exact Mass306.11
IUPAC Name(1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium
SMILESCC(C)C(C#N)(O[Si](C)(C)C)[P+](=O)O[Si](C)(C)C
InChIInChI=1S/C11H25NO3PSi2/c1-10(2)11(9-12,14-17(3,4)5)16(13)15-18(6,7)8/h10H,1-8H3/q+1
InChIKeyGMYUVXMGAFODGQ-UHFFFAOYSA-N
XLogP4.31
TPSA59.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.47
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium 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 (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium?
The IUPAC name of (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium (CID 23264770) is (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium.
What is the SMILES notation for (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium?
The canonical SMILES for (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium is CC(C)C(C#N)(O[Si](C)(C)C)[P+](=O)O[Si](C)(C)C.
What is the InChIKey of (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium?
The InChIKey is GMYUVXMGAFODGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3PSi2/c1-10(2)11(9-12,14-17(3,4)5)16(13)15-18(6,7)8/h10H,1-8H3/q+1.
What are the key properties of (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium?
(1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium has a molecular weight of 306.47 g/mol, XLogP of 4.31, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyano-2-methyl-1-trimethylsilyloxypropyl)-oxo-trimethylsilyloxyphosphanium is sourced from PubChem (CID 23264770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).