4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol

C11H19NO2 — CID 130595134

IUPAC4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol
SMILESOC1COCC1N1CC2CCC1CC2
InChIInChI=1S/C11H19NO2/c13-11-7-14-6-10(11)12-5-8-1-3-9(12)4-2-8/h8-11,13H,1-7H2
InChIKeyOGOMHUYKNPPZDM-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.62
Rot. Bonds1

About 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol

4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol (PubChem CID 130595134) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol.

Molecular Properties

Compound Name4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol
PubChem CID130595134
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol
SMILESOC1COCC1N1CC2CCC1CC2
InChIInChI=1S/C11H19NO2/c13-11-7-14-6-10(11)12-5-8-1-3-9(12)4-2-8/h8-11,13H,1-7H2
InChIKeyOGOMHUYKNPPZDM-UHFFFAOYSA-N
XLogP0.62
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(Cyclohexylmethyl)-5-methylmorpholin-2-yl]methanol
CID 81213944
[5-Methyl-4-(4-methylcyclohexyl)morpholin-2-yl]methanol
CID 81218660
[5-Methyl-4-(3-methylcyclohexyl)morpholin-2-yl]methanol
CID 81218661
[4-(4-Ethylcyclohexyl)-5-methylmorpholin-2-yl]methanol
CID 81218984
[4-(4-Methylcyclohexyl)morpholin-2-yl]methanol
CID 81219136
[4-(3-Methylcyclohexyl)morpholin-2-yl]methanol
CID 81219137
[4-(4-Ethylcyclohexyl)morpholin-2-yl]methanol
CID 81219698
[6-Methyl-4-(3-methylcyclohexyl)morpholin-2-yl]methanol
CID 102935821
[4-(4-Ethylcyclohexyl)-6-methylmorpholin-2-yl]methanol
CID 102935822
[6-Methyl-4-(4-methylcyclohexyl)morpholin-2-yl]methanol
CID 102935823
[4-(2-Cyclohexylethyl)-5-methylmorpholin-2-yl]methanol
CID 113263209
[4-(4-Ethylcyclohexyl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114779894

Frequently Asked Questions

What is the IUPAC name of 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol?
The IUPAC name of 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol (CID 130595134) is 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol.
What is the SMILES notation for 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol?
The canonical SMILES for 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol is OC1COCC1N1CC2CCC1CC2.
What is the InChIKey of 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol?
The InChIKey is OGOMHUYKNPPZDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-11-7-14-6-10(11)12-5-8-1-3-9(12)4-2-8/h8-11,13H,1-7H2.
What are the key properties of 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol?
4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol has a molecular weight of 197.28 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-azabicyclo[2.2.2]octan-2-yl)oxolan-3-ol is sourced from PubChem (CID 130595134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).