tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane

C12H27NO2Si — CID 18461952

IUPACtert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane
SMILESCO[Si](OC)(N1CCCCC1C)C(C)(C)C
InChIInChI=1S/C12H27NO2Si/c1-11-9-7-8-10-13(11)16(14-5,15-6)12(2,3)4/h11H,7-10H2,1-6H3
InChIKeyXEKIUNGYKBLGIP-UHFFFAOYSA-N
MW245.44 g/mol
LogP2.89
Rot. Bonds3

About tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane

tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane (PubChem CID 18461952) has the molecular formula C12H27NO2Si and a molecular weight of 245.44 g/mol. Its IUPAC name is tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane.

Molecular Properties

Compound Nametert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane
PubChem CID18461952
Molecular FormulaC12H27NO2Si
Molecular Weight245.44 g/mol
Exact Mass245.18
IUPAC Nametert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane
SMILESCO[Si](OC)(N1CCCCC1C)C(C)(C)C
InChIInChI=1S/C12H27NO2Si/c1-11-9-7-8-10-13(11)16(14-5,15-6)12(2,3)4/h11H,7-10H2,1-6H3
InChIKeyXEKIUNGYKBLGIP-UHFFFAOYSA-N
XLogP2.89
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.44
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane?
The IUPAC name of tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane (CID 18461952) is tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane.
What is the SMILES notation for tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane?
The canonical SMILES for tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane is CO[Si](OC)(N1CCCCC1C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane?
The InChIKey is XEKIUNGYKBLGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO2Si/c1-11-9-7-8-10-13(11)16(14-5,15-6)12(2,3)4/h11H,7-10H2,1-6H3.
What are the key properties of tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane?
tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane has a molecular weight of 245.44 g/mol, XLogP of 2.89, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethoxy-(2-methylpiperidin-1-yl)silane is sourced from PubChem (CID 18461952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).