tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane

C13H27NOSi — CID 175972966

IUPACtert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane
SMILESC=C1CC[C@@H](CO[Si](C)(C)C(C)(C)C)NC1
InChIInChI=1S/C13H27NOSi/c1-11-7-8-12(14-9-11)10-15-16(5,6)13(2,3)4/h12,14H,1,7-10H2,2-6H3/t12-/m0/s1
InChIKeyFTUGNWCMWYLHTL-LBPRGKRZSA-N
MW241.45 g/mol
LogP3.32
Rot. Bonds3

About tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane

tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane (PubChem CID 175972966) has the molecular formula C13H27NOSi and a molecular weight of 241.45 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane
PubChem CID175972966
Molecular FormulaC13H27NOSi
Molecular Weight241.45 g/mol
Exact Mass241.19
IUPAC Nametert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane
SMILESC=C1CC[C@@H](CO[Si](C)(C)C(C)(C)C)NC1
InChIInChI=1S/C13H27NOSi/c1-11-7-8-12(14-9-11)10-15-16(5,6)13(2,3)4/h12,14H,1,7-10H2,2-6H3/t12-/m0/s1
InChIKeyFTUGNWCMWYLHTL-LBPRGKRZSA-N
XLogP3.32
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.45
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane (CID 175972966) is tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane is C=C1CC[C@@H](CO[Si](C)(C)C(C)(C)C)NC1.
What is the InChIKey of tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane?
The InChIKey is FTUGNWCMWYLHTL-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H27NOSi/c1-11-7-8-12(14-9-11)10-15-16(5,6)13(2,3)4/h12,14H,1,7-10H2,2-6H3/t12-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane?
tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane has a molecular weight of 241.45 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[(2S)-5-methylidenepiperidin-2-yl]methoxy]silane is sourced from PubChem (CID 175972966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).