[(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane

C13H24OSi — CID 72735701

IUPAC[(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane
SMILESC=C1O[C@@H](C2CCCCC2)[C@H]1[Si](C)(C)C
InChIInChI=1S/C13H24OSi/c1-10-13(15(2,3)4)12(14-10)11-8-6-5-7-9-11/h11-13H,1,5-9H2,2-4H3/t12-,13-/m0/s1
InChIKeyMIEUOFWFZREWEG-STQMWFEESA-N
MW224.42 g/mol
LogP4.19
Rot. Bonds2

About [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane

[(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane (PubChem CID 72735701) has the molecular formula C13H24OSi and a molecular weight of 224.42 g/mol. Its IUPAC name is [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane.

Molecular Properties

Compound Name[(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane
PubChem CID72735701
Molecular FormulaC13H24OSi
Molecular Weight224.42 g/mol
Exact Mass224.16
IUPAC Name[(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane
SMILESC=C1O[C@@H](C2CCCCC2)[C@H]1[Si](C)(C)C
InChIInChI=1S/C13H24OSi/c1-10-13(15(2,3)4)12(14-10)11-8-6-5-7-9-11/h11-13H,1,5-9H2,2-4H3/t12-,13-/m0/s1
InChIKeyMIEUOFWFZREWEG-STQMWFEESA-N
XLogP4.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-cyclohexyl-4-methyl-1,3-oxazolidin-2-one
CID 44558834
4,5-dicyclohexyl-2-propan-2-ylidene-1,3-dioxolane
CID 174373573
(2S,3R)-2,3-dicyclohexyloxirane
CID 169013366
(3S,4R)-4-cyclohexyl-3-methyloxetan-2-one
CID 11275238
(3-cyclohexyloxiran-2-yl)-methylsilane
CID 175312810
(3-cyclohexyloxiran-2-yl)-methylsilane;hydrate
CID 175312809
(4S,5S)-4,5-dicyclohexyl-2-methyl-1,3,2-dioxaborolane
CID 10354715
(4S,5R)-5-cyclohexyl-4-(1-iodoethenyl)-1,3-oxazolidin-2-one
CID 15698611
2-cyclohexyl-5-methylidene-1,3-dioxolan-4-one
CID 14564325
cyclononylcycloicosane
CID 123187062
(4aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 58427678
cyclohexylcycloheptane
CID 524589

Frequently Asked Questions

What is the IUPAC name of [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane?
The IUPAC name of [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane (CID 72735701) is [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane.
What is the SMILES notation for [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane?
The canonical SMILES for [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane is C=C1O[C@@H](C2CCCCC2)[C@H]1[Si](C)(C)C.
What is the InChIKey of [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane?
The InChIKey is MIEUOFWFZREWEG-STQMWFEESA-N. The full InChI is InChI=1S/C13H24OSi/c1-10-13(15(2,3)4)12(14-10)11-8-6-5-7-9-11/h11-13H,1,5-9H2,2-4H3/t12-,13-/m0/s1.
What are the key properties of [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane?
[(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane has a molecular weight of 224.42 g/mol, XLogP of 4.19, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,3R)-2-cyclohexyl-4-methylideneoxetan-3-yl]-trimethylsilane is sourced from PubChem (CID 72735701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).