cyclohexyl(triethylsilyl)methanone

C13H26OSi — CID 15093454

IUPACcyclohexyl(triethylsilyl)methanone
SMILESCC[Si](CC)(CC)C(=O)C1CCCCC1
InChIInChI=1S/C13H26OSi/c1-4-15(5-2,6-3)13(14)12-10-8-7-9-11-12/h12H,4-11H2,1-3H3
InChIKeyPTLKDMXDNVOVHC-UHFFFAOYSA-N
MW226.44 g/mol
LogP4.18
Rot. Bonds5

About cyclohexyl(triethylsilyl)methanone

cyclohexyl(triethylsilyl)methanone (PubChem CID 15093454) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is cyclohexyl(triethylsilyl)methanone.

Molecular Properties

Compound Namecyclohexyl(triethylsilyl)methanone
PubChem CID15093454
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Namecyclohexyl(triethylsilyl)methanone
SMILESCC[Si](CC)(CC)C(=O)C1CCCCC1
InChIInChI=1S/C13H26OSi/c1-4-15(5-2,6-3)13(14)12-10-8-7-9-11-12/h12H,4-11H2,1-3H3
InChIKeyPTLKDMXDNVOVHC-UHFFFAOYSA-N
XLogP4.18
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze cyclohexyl(triethylsilyl)methanone 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

2-cyclohexylpent-2-enoic acid
CID 67108594
1-cyclopentylethanone;propane
CID 145026358
N-cyclohexyl-N-ethylcyclobutanecarboxamide
CID 78833458
1-cycloheptylbutan-1-one
CID 54353743
(Z)-3-cyclohexyl-2-ethylbut-2-enoic acid
CID 165441204
1-cyclohexyl-2-ethylpolanylethanone
CID 145029687
1-cycloheptylpentan-1-one
CID 65399298
ethyl cyclohexanecarboxylate;hydrochloride
CID 68985516
cyclohexanecarboxylic acid;N-ethylethanamine
CID 175970280
lithium;cyclooctanecarboxylic acid;hydride
CID 173424430
2-cyclododecyl-2-oxoacetic acid
CID 20976833
1-cyclohexyl-2-[cyclopentyl(ethyl)amino]ethanone
CID 104750031

Frequently Asked Questions

What is the IUPAC name of cyclohexyl(triethylsilyl)methanone?
The IUPAC name of cyclohexyl(triethylsilyl)methanone (CID 15093454) is cyclohexyl(triethylsilyl)methanone.
What is the SMILES notation for cyclohexyl(triethylsilyl)methanone?
The canonical SMILES for cyclohexyl(triethylsilyl)methanone is CC[Si](CC)(CC)C(=O)C1CCCCC1.
What is the InChIKey of cyclohexyl(triethylsilyl)methanone?
The InChIKey is PTLKDMXDNVOVHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-4-15(5-2,6-3)13(14)12-10-8-7-9-11-12/h12H,4-11H2,1-3H3.
What are the key properties of cyclohexyl(triethylsilyl)methanone?
cyclohexyl(triethylsilyl)methanone has a molecular weight of 226.44 g/mol, XLogP of 4.18, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl(triethylsilyl)methanone is sourced from PubChem (CID 15093454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).