cyclohexyl-[dimethyl(phenyl)silyl]methanone

C15H22OSi — CID 10083292

IUPACcyclohexyl-[dimethyl(phenyl)silyl]methanone
SMILESC[Si](C)(C(=O)C1CCCCC1)c1ccccc1
InChIInChI=1S/C15H22OSi/c1-17(2,14-11-7-4-8-12-14)15(16)13-9-5-3-6-10-13/h4,7-8,11-13H,3,5-6,9-10H2,1-2H3
InChIKeyCWTOWDBJNUTASP-UHFFFAOYSA-N
MW246.43 g/mol
LogP3.29
Rot. Bonds3

About cyclohexyl-[dimethyl(phenyl)silyl]methanone

cyclohexyl-[dimethyl(phenyl)silyl]methanone (PubChem CID 10083292) has the molecular formula C15H22OSi and a molecular weight of 246.43 g/mol. Its IUPAC name is cyclohexyl-[dimethyl(phenyl)silyl]methanone.

Molecular Properties

Compound Namecyclohexyl-[dimethyl(phenyl)silyl]methanone
PubChem CID10083292
Molecular FormulaC15H22OSi
Molecular Weight246.43 g/mol
Exact Mass246.14
IUPAC Namecyclohexyl-[dimethyl(phenyl)silyl]methanone
SMILESC[Si](C)(C(=O)C1CCCCC1)c1ccccc1
InChIInChI=1S/C15H22OSi/c1-17(2,14-11-7-4-8-12-14)15(16)13-9-5-3-6-10-13/h4,7-8,11-13H,3,5-6,9-10H2,1-2H3
InChIKeyCWTOWDBJNUTASP-UHFFFAOYSA-N
XLogP3.29
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.43
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[dimethyl(phenyl)silyl]methanone?
The IUPAC name of cyclohexyl-[dimethyl(phenyl)silyl]methanone (CID 10083292) is cyclohexyl-[dimethyl(phenyl)silyl]methanone.
What is the SMILES notation for cyclohexyl-[dimethyl(phenyl)silyl]methanone?
The canonical SMILES for cyclohexyl-[dimethyl(phenyl)silyl]methanone is C[Si](C)(C(=O)C1CCCCC1)c1ccccc1.
What is the InChIKey of cyclohexyl-[dimethyl(phenyl)silyl]methanone?
The InChIKey is CWTOWDBJNUTASP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22OSi/c1-17(2,14-11-7-4-8-12-14)15(16)13-9-5-3-6-10-13/h4,7-8,11-13H,3,5-6,9-10H2,1-2H3.
What are the key properties of cyclohexyl-[dimethyl(phenyl)silyl]methanone?
cyclohexyl-[dimethyl(phenyl)silyl]methanone has a molecular weight of 246.43 g/mol, XLogP of 3.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[dimethyl(phenyl)silyl]methanone is sourced from PubChem (CID 10083292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).