2,2-diethylsiletane

C7H16Si — CID 123533855

IUPAC2,2-diethylsiletane
SMILESCCC1(CC)CC[SiH2]1
InChIInChI=1S/C7H16Si/c1-3-7(4-2)5-6-8-7/h3-6,8H2,1-2H3
InChIKeyMWDDKNCJARSKTO-UHFFFAOYSA-N
MW128.29 g/mol
LogP1.96
Rot. Bonds2

About 2,2-diethylsiletane

2,2-diethylsiletane (PubChem CID 123533855) has the molecular formula C7H16Si and a molecular weight of 128.29 g/mol. Its IUPAC name is 2,2-diethylsiletane.

Molecular Properties

Compound Name2,2-diethylsiletane
PubChem CID123533855
Molecular FormulaC7H16Si
Molecular Weight128.29 g/mol
Exact Mass128.10
IUPAC Name2,2-diethylsiletane
SMILESCCC1(CC)CC[SiH2]1
InChIInChI=1S/C7H16Si/c1-3-7(4-2)5-6-8-7/h3-6,8H2,1-2H3
InChIKeyMWDDKNCJARSKTO-UHFFFAOYSA-N
XLogP1.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.29
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2,2-diethylsiletane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,3-Diethylsiletane
CID 15720725
CID 20675882
CID 20675882
CID 71373499
CID 71373499
Dimethyl(3-methylpentan-3-yl)silane
CID 123160365
1-(3-Ethylpentyl)siletane
CID 123403024
1,2,2-Trimethylsiletane
CID 123582844
Diethyl(3-methylpentan-3-yl)silane
CID 123794470
Methyl(3-methylpentan-3-yl)silane
CID 123998411
2,2,4,4-Tetramethylsiletane
CID 154148680
3-Ethylpentan-3-yl(methyl)silane
CID 154308389
Methyl-(3-methyl-3-silylpentyl)silane
CID 173519853
1,1,2,2-Tetramethylsiletane
CID 173920391

Frequently Asked Questions

What is the IUPAC name of 2,2-diethylsiletane?
The IUPAC name of 2,2-diethylsiletane (CID 123533855) is 2,2-diethylsiletane.
What is the SMILES notation for 2,2-diethylsiletane?
The canonical SMILES for 2,2-diethylsiletane is CCC1(CC)CC[SiH2]1.
What is the InChIKey of 2,2-diethylsiletane?
The InChIKey is MWDDKNCJARSKTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16Si/c1-3-7(4-2)5-6-8-7/h3-6,8H2,1-2H3.
What are the key properties of 2,2-diethylsiletane?
2,2-diethylsiletane has a molecular weight of 128.29 g/mol, XLogP of 1.96, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethylsiletane is sourced from PubChem (CID 123533855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).