1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane

C10H21NOSi — CID 524282

IUPAC1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane
SMILESC[Si](C)(C)OC1CN2CCC1CC2
InChIInChI=1S/C10H21NOSi/c1-13(2,3)12-10-8-11-6-4-9(10)5-7-11/h9-10H,4-8H2,1-3H3
InChIKeyQYBKWHMRDRKMQN-UHFFFAOYSA-N
MW199.37 g/mol
LogP1.93
Rot. Bonds2

About 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane

1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane (PubChem CID 524282) has the molecular formula C10H21NOSi and a molecular weight of 199.37 g/mol. Its IUPAC name is 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane.

Molecular Properties

Compound Name1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane
PubChem CID524282
Molecular FormulaC10H21NOSi
Molecular Weight199.37 g/mol
Exact Mass199.14
IUPAC Name1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane
SMILESC[Si](C)(C)OC1CN2CCC1CC2
InChIInChI=1S/C10H21NOSi/c1-13(2,3)12-10-8-11-6-4-9(10)5-7-11/h9-10H,4-8H2,1-3H3
InChIKeyQYBKWHMRDRKMQN-UHFFFAOYSA-N
XLogP1.93
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.37
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(2,2-dimethylpropoxy)-1-azabicyclo[2.2.2]octane
CID 155249477
3-butan-2-yloxy-1-azabicyclo[2.2.2]octane
CID 88985997
1-azabicyclo[2.2.2]octan-3-yl hydrogen carbonate
CID 68769471
[4-(1-azabicyclo[2.2.2]octan-3-yloxy)phenyl]-trimethylstannane
CID 21072606
2-O-[(3R)-1-azabicyclo[2.2.2]octan-3-yl] 1-O-methyl oxalate;ethane
CID 142413084
2-[[(3R)-1-azabicyclo[2.2.2]octan-3-yl]oxy]ethanol
CID 101160976
ethane;3-(4-methylphenoxy)-1-azabicyclo[2.2.2]octane
CID 143919466
(3S)-3-(2,6-dimethylphenoxy)-1-azabicyclo[2.2.2]octane
CID 100974214
1-azabicyclo[2.2.2]octan-3-yl ethyl carbonate;hydrochloride
CID 17141162
3-(5-fluoropyrimidin-2-yl)oxy-1-azabicyclo[2.2.2]octane
CID 126953876
3-ethoxy-1-azabicyclo[2.2.1]heptane
CID 19848684
methane;(3S)-3-methyl-1-azabicyclo[2.2.2]octane
CID 158724020

Frequently Asked Questions

What is the IUPAC name of 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane?
The IUPAC name of 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane (CID 524282) is 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane.
What is the SMILES notation for 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane?
The canonical SMILES for 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane is C[Si](C)(C)OC1CN2CCC1CC2.
What is the InChIKey of 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane?
The InChIKey is QYBKWHMRDRKMQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NOSi/c1-13(2,3)12-10-8-11-6-4-9(10)5-7-11/h9-10H,4-8H2,1-3H3.
What are the key properties of 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane?
1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane has a molecular weight of 199.37 g/mol, XLogP of 1.93, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azabicyclo[2.2.2]octan-3-yloxy(trimethyl)silane is sourced from PubChem (CID 524282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).