(2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile

C11H21NOSi — CID 11805988

IUPAC(2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile
SMILESC[Si](C)(C)O[C@H](C#N)C1CCCCC1
InChIInChI=1S/C11H21NOSi/c1-14(2,3)13-11(9-12)10-7-5-4-6-8-10/h10-11H,4-8H2,1-3H3/t11-/m1/s1
InChIKeyADQRFFPSGQWYCS-LLVKDONJSA-N
MW211.38 g/mol
LogP3.31
Rot. Bonds3

About (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile

(2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile (PubChem CID 11805988) has the molecular formula C11H21NOSi and a molecular weight of 211.38 g/mol. Its IUPAC name is (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile.

Molecular Properties

Compound Name(2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile
PubChem CID11805988
Molecular FormulaC11H21NOSi
Molecular Weight211.38 g/mol
Exact Mass211.14
IUPAC Name(2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile
SMILESC[Si](C)(C)O[C@H](C#N)C1CCCCC1
InChIInChI=1S/C11H21NOSi/c1-14(2,3)13-11(9-12)10-7-5-4-6-8-10/h10-11H,4-8H2,1-3H3/t11-/m1/s1
InChIKeyADQRFFPSGQWYCS-LLVKDONJSA-N
XLogP3.31
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.38
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile 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

1-cyclohexylethoxy(trimethyl)silane
CID 20821444
3-cyclohexyl-2,2-bis(trimethylsilyl)-3-trimethylsilyloxypropanenitrile
CID 134873239
2-(3,5-dimethylcyclohex-3-en-1-yl)-2-trimethylsilyloxyacetonitrile
CID 103277378
[cyano(cyclohexyl)methyl] diethyl phosphate
CID 11716034
2-cyclohexylpropanedinitrile
CID 11171058
[(Z,1R)-1-cyclohexyl-3-iodoprop-2-enoxy]-trimethylsilane
CID 22822227
2-cyclohexylpropanedinitrile;methane
CID 142914800
cyclohexyl-dimethyl-propan-2-yloxysilane
CID 575965
[(1S)-1-cyclohexylethyl] cyanate
CID 58109695
tert-butyl-(1-cyclopentylprop-2-ynoxy)-dimethylsilane
CID 14314323
(2S)-2-cyclohexyl-2-fluoroacetonitrile
CID 11040792
(2S)-2-chloro-2-cyclohexylacetonitrile
CID 94056855

Frequently Asked Questions

What is the IUPAC name of (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile?
The IUPAC name of (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile (CID 11805988) is (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile.
What is the SMILES notation for (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile?
The canonical SMILES for (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile is C[Si](C)(C)O[C@H](C#N)C1CCCCC1.
What is the InChIKey of (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile?
The InChIKey is ADQRFFPSGQWYCS-LLVKDONJSA-N. The full InChI is InChI=1S/C11H21NOSi/c1-14(2,3)13-11(9-12)10-7-5-4-6-8-10/h10-11H,4-8H2,1-3H3/t11-/m1/s1.
What are the key properties of (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile?
(2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile has a molecular weight of 211.38 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-cyclohexyl-2-trimethylsilyloxyacetonitrile is sourced from PubChem (CID 11805988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).