3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol

C11H21NO — CID 67587119

IUPAC3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol
SMILESCCN1C2CCC1CC(O)(CC)C2
InChIInChI=1S/C11H21NO/c1-3-11(13)7-9-5-6-10(8-11)12(9)4-2/h9-10,13H,3-8H2,1-2H3
InChIKeyGKKPXUZRZUFNFD-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.77
Rot. Bonds2

About 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol

3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol (PubChem CID 67587119) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol.

Molecular Properties

Compound Name3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol
PubChem CID67587119
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol
SMILESCCN1C2CCC1CC(O)(CC)C2
InChIInChI=1S/C11H21NO/c1-3-11(13)7-9-5-6-10(8-11)12(9)4-2/h9-10,13H,3-8H2,1-2H3
InChIKeyGKKPXUZRZUFNFD-UHFFFAOYSA-N
XLogP1.77
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol?
The IUPAC name of 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol (CID 67587119) is 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol.
What is the SMILES notation for 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol?
The canonical SMILES for 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol is CCN1C2CCC1CC(O)(CC)C2.
What is the InChIKey of 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol?
The InChIKey is GKKPXUZRZUFNFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-11(13)7-9-5-6-10(8-11)12(9)4-2/h9-10,13H,3-8H2,1-2H3.
What are the key properties of 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol?
3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol has a molecular weight of 183.29 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-diethyl-8-azabicyclo[3.2.1]octan-3-ol is sourced from PubChem (CID 67587119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).