cyclononyl-diethyl-propan-2-ylsilane

C16H34Si — CID 70177803

IUPACcyclononyl-diethyl-propan-2-ylsilane
SMILESCC[Si](CC)(C(C)C)C1CCCCCCCC1
InChIInChI=1S/C16H34Si/c1-5-17(6-2,15(3)4)16-13-11-9-7-8-10-12-14-16/h15-16H,5-14H2,1-4H3
InChIKeyPUUMOIJMXRGMST-UHFFFAOYSA-N
MW254.53 g/mol
LogP6.39
Rot. Bonds4

About cyclononyl-diethyl-propan-2-ylsilane

cyclononyl-diethyl-propan-2-ylsilane (PubChem CID 70177803) has the molecular formula C16H34Si and a molecular weight of 254.53 g/mol. Its IUPAC name is cyclononyl-diethyl-propan-2-ylsilane.

Molecular Properties

Compound Namecyclononyl-diethyl-propan-2-ylsilane
PubChem CID70177803
Molecular FormulaC16H34Si
Molecular Weight254.53 g/mol
Exact Mass254.24
IUPAC Namecyclononyl-diethyl-propan-2-ylsilane
SMILESCC[Si](CC)(C(C)C)C1CCCCCCCC1
InChIInChI=1S/C16H34Si/c1-5-17(6-2,15(3)4)16-13-11-9-7-8-10-12-14-16/h15-16H,5-14H2,1-4H3
InChIKeyPUUMOIJMXRGMST-UHFFFAOYSA-N
XLogP6.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.53
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze cyclononyl-diethyl-propan-2-ylsilane 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-diethyl-propan-2-ylsilane?
The IUPAC name of cyclononyl-diethyl-propan-2-ylsilane (CID 70177803) is cyclononyl-diethyl-propan-2-ylsilane.
What is the SMILES notation for cyclononyl-diethyl-propan-2-ylsilane?
The canonical SMILES for cyclononyl-diethyl-propan-2-ylsilane is CC[Si](CC)(C(C)C)C1CCCCCCCC1.
What is the InChIKey of cyclononyl-diethyl-propan-2-ylsilane?
The InChIKey is PUUMOIJMXRGMST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34Si/c1-5-17(6-2,15(3)4)16-13-11-9-7-8-10-12-14-16/h15-16H,5-14H2,1-4H3.
What are the key properties of cyclononyl-diethyl-propan-2-ylsilane?
cyclononyl-diethyl-propan-2-ylsilane has a molecular weight of 254.53 g/mol, XLogP of 6.39, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclononyl-diethyl-propan-2-ylsilane is sourced from PubChem (CID 70177803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).