1,2-dicyclohexyl-2-trimethylsilyloxyethanone

C17H32O2Si — CID 10590062

IUPAC1,2-dicyclohexyl-2-trimethylsilyloxyethanone
SMILESC[Si](C)(C)OC(C(=O)C1CCCCC1)C1CCCCC1
InChIInChI=1S/C17H32O2Si/c1-20(2,3)19-17(15-12-8-5-9-13-15)16(18)14-10-6-4-7-11-14/h14-15,17H,4-13H2,1-3H3
InChIKeyKFRVISSIHQHMKZ-UHFFFAOYSA-N
MW296.53 g/mol
LogP4.94
Rot. Bonds5

About 1,2-dicyclohexyl-2-trimethylsilyloxyethanone

1,2-dicyclohexyl-2-trimethylsilyloxyethanone (PubChem CID 10590062) has the molecular formula C17H32O2Si and a molecular weight of 296.53 g/mol. Its IUPAC name is 1,2-dicyclohexyl-2-trimethylsilyloxyethanone.

Molecular Properties

Compound Name1,2-dicyclohexyl-2-trimethylsilyloxyethanone
PubChem CID10590062
Molecular FormulaC17H32O2Si
Molecular Weight296.53 g/mol
Exact Mass296.22
IUPAC Name1,2-dicyclohexyl-2-trimethylsilyloxyethanone
SMILESC[Si](C)(C)OC(C(=O)C1CCCCC1)C1CCCCC1
InChIInChI=1S/C17H32O2Si/c1-20(2,3)19-17(15-12-8-5-9-13-15)16(18)14-10-6-4-7-11-14/h14-15,17H,4-13H2,1-3H3
InChIKeyKFRVISSIHQHMKZ-UHFFFAOYSA-N
XLogP4.94
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.53
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1,2-dicyclohexyl-2-trimethylsilyloxyethanone 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-[4-[Tert-butyl(dimethyl)silyl]oxybutyl]cyclohexan-1-one
CID 10085307
(1S)-1-{[tert-Butyl(dimethyl)silyl]oxy}-1-cyclohexylbutan-2-one
CID 13228831
(1R)-1-{[tert-Butyl(dimethyl)silyl]oxy}-1-cyclohexylbutan-2-one
CID 71421165
(1R)-1-[tert-butylsilyloxy(dimethyl)silyl]oxy-1-cyclohexyl-4,4,4-trifluoro-3-methylbutan-2-one
CID 150817053
trans-(2R,3S)-3-ethyl-2-trimethylsilyloxycyclohexan-1-one
CID 11344921
1,2-Dicyclohexyl-1-trimethylsilyloxypentan-3-one
CID 134838782
(2S)-2-[tert-butyl(dimethyl)silyl]oxy-2-cyclohexylpentan-3-one
CID 135050235
(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-cyclohexyl-4,4,4-trifluoro-3-methylbutan-2-one
CID 102253975
2-[Tert-butyl(dimethyl)silyl]oxy-1,2-dicyclohexylethanone
CID 10759483
2-[Tert-butyl(dimethyl)silyl]oxy-1-cyclohexylethanone
CID 11357321
9-[Tert-butyl(dimethyl)silyl]oxyspiro[5.5]undecan-3-one
CID 19390045
4-(2-Triisopropylsilanyloxy-ethyl)-cyclohexanone
CID 21986099

Frequently Asked Questions

What is the IUPAC name of 1,2-dicyclohexyl-2-trimethylsilyloxyethanone?
The IUPAC name of 1,2-dicyclohexyl-2-trimethylsilyloxyethanone (CID 10590062) is 1,2-dicyclohexyl-2-trimethylsilyloxyethanone.
What is the SMILES notation for 1,2-dicyclohexyl-2-trimethylsilyloxyethanone?
The canonical SMILES for 1,2-dicyclohexyl-2-trimethylsilyloxyethanone is C[Si](C)(C)OC(C(=O)C1CCCCC1)C1CCCCC1.
What is the InChIKey of 1,2-dicyclohexyl-2-trimethylsilyloxyethanone?
The InChIKey is KFRVISSIHQHMKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O2Si/c1-20(2,3)19-17(15-12-8-5-9-13-15)16(18)14-10-6-4-7-11-14/h14-15,17H,4-13H2,1-3H3.
What are the key properties of 1,2-dicyclohexyl-2-trimethylsilyloxyethanone?
1,2-dicyclohexyl-2-trimethylsilyloxyethanone has a molecular weight of 296.53 g/mol, XLogP of 4.94, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dicyclohexyl-2-trimethylsilyloxyethanone is sourced from PubChem (CID 10590062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).