tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane

C16H23NOSi — CID 54324291

IUPACtert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane
SMILESCC(C)(C)[Si](C)(C)OCc1ccc2ccccc2n1
InChIInChI=1S/C16H23NOSi/c1-16(2,3)19(4,5)18-12-14-11-10-13-8-6-7-9-15(13)17-14/h6-11H,12H2,1-5H3
InChIKeySTUXIKRCJITGMY-UHFFFAOYSA-N
MW273.45 g/mol
LogP4.76
Rot. Bonds3

About tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane

tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane (PubChem CID 54324291) has the molecular formula C16H23NOSi and a molecular weight of 273.45 g/mol. Its IUPAC name is tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane
PubChem CID54324291
Molecular FormulaC16H23NOSi
Molecular Weight273.45 g/mol
Exact Mass273.15
IUPAC Nametert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane
SMILESCC(C)(C)[Si](C)(C)OCc1ccc2ccccc2n1
InChIInChI=1S/C16H23NOSi/c1-16(2,3)19(4,5)18-12-14-11-10-13-8-6-7-9-15(13)17-14/h6-11H,12H2,1-5H3
InChIKeySTUXIKRCJITGMY-UHFFFAOYSA-N
XLogP4.76
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.45
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-dimethyl-(quinolin-2-ylmethoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane (CID 54324291) is tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane is CC(C)(C)[Si](C)(C)OCc1ccc2ccccc2n1.
What is the InChIKey of tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane?
The InChIKey is STUXIKRCJITGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NOSi/c1-16(2,3)19(4,5)18-12-14-11-10-13-8-6-7-9-15(13)17-14/h6-11H,12H2,1-5H3.
What are the key properties of tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane?
tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane has a molecular weight of 273.45 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane is sourced from PubChem (CID 54324291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).