cyclononyl-cyclopropyl-diethoxysilane

C16H32O2Si — CID 139768397

IUPACcyclononyl-cyclopropyl-diethoxysilane
SMILESCCO[Si](OCC)(C1CCCCCCCC1)C1CC1
InChIInChI=1S/C16H32O2Si/c1-3-17-19(18-4-2,16-13-14-16)15-11-9-7-5-6-8-10-12-15/h15-16H,3-14H2,1-2H3
InChIKeyYNSOMLIMOYMJGC-UHFFFAOYSA-N
MW284.52 g/mol
LogP5.17
Rot. Bonds6

About cyclononyl-cyclopropyl-diethoxysilane

cyclononyl-cyclopropyl-diethoxysilane (PubChem CID 139768397) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is cyclononyl-cyclopropyl-diethoxysilane.

Molecular Properties

Compound Namecyclononyl-cyclopropyl-diethoxysilane
PubChem CID139768397
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Namecyclononyl-cyclopropyl-diethoxysilane
SMILESCCO[Si](OCC)(C1CCCCCCCC1)C1CC1
InChIInChI=1S/C16H32O2Si/c1-3-17-19(18-4-2,16-13-14-16)15-11-9-7-5-6-8-10-12-15/h15-16H,3-14H2,1-2H3
InChIKeyYNSOMLIMOYMJGC-UHFFFAOYSA-N
XLogP5.17
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.52
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze cyclononyl-cyclopropyl-diethoxysilane 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 cyclononyl-cyclopropyl-diethoxysilane?
The IUPAC name of cyclononyl-cyclopropyl-diethoxysilane (CID 139768397) is cyclononyl-cyclopropyl-diethoxysilane.
What is the SMILES notation for cyclononyl-cyclopropyl-diethoxysilane?
The canonical SMILES for cyclononyl-cyclopropyl-diethoxysilane is CCO[Si](OCC)(C1CCCCCCCC1)C1CC1.
What is the InChIKey of cyclononyl-cyclopropyl-diethoxysilane?
The InChIKey is YNSOMLIMOYMJGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-3-17-19(18-4-2,16-13-14-16)15-11-9-7-5-6-8-10-12-15/h15-16H,3-14H2,1-2H3.
What are the key properties of cyclononyl-cyclopropyl-diethoxysilane?
cyclononyl-cyclopropyl-diethoxysilane has a molecular weight of 284.52 g/mol, XLogP of 5.17, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclononyl-cyclopropyl-diethoxysilane is sourced from PubChem (CID 139768397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).