1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol

C10H19NO — CID 130146305

IUPAC1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol
SMILESCN1C2CCCC1(C)CC(O)C2
InChIInChI=1S/C10H19NO/c1-10-5-3-4-8(11(10)2)6-9(12)7-10/h8-9,12H,3-7H2,1-2H3
InChIKeyCYXOCSCFUDBIQA-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.38
Rot. Bonds

About 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol

1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol (PubChem CID 130146305) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol.

Molecular Properties

Compound Name1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol
PubChem CID130146305
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol
SMILESCN1C2CCCC1(C)CC(O)C2
InChIInChI=1S/C10H19NO/c1-10-5-3-4-8(11(10)2)6-9(12)7-10/h8-9,12H,3-7H2,1-2H3
InChIKeyCYXOCSCFUDBIQA-UHFFFAOYSA-N
XLogP1.38
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1,2-dimethyl-2-azabicyclo[3.3.1]nonane
CID 174346440
1-(1-methylcyclopentyl)piperidin-4-ol
CID 67281081
(1R,3S,5S)-1,8-dimethyl-3-(4-methylphenyl)-8-azabicyclo[3.2.1]octane
CID 139885411
1-(1-methylcyclooctyl)piperidin-4-ol
CID 67281005
(1R,5R)-9-propyl-9-azabicyclo[3.3.1]nonan-3-ol
CID 98069991
(1R,3S,5S)-1-fluorobicyclo[3.3.1]nonan-3-ol
CID 131065383
(1S,5S)-9-propyl-9-azabicyclo[3.3.1]nonan-3-ol
CID 98069992
(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-(1-methylcyclopentyl)methanone
CID 78993922
(1S,5R)-13-azatricyclo[7.3.1.05,13]tridecan-3-ol
CID 131019218
5,5-dimethylcyclononan-1-ol
CID 130122952
(3aS,6aS)-6a-(hydroxymethyl)-2,3,3a,4,5,6-hexahydro-1H-pentalen-2-ol
CID 131201463
(1R,5R)-9-cyclopropyl-9-azabicyclo[3.3.1]nonan-3-ol
CID 98113652

Frequently Asked Questions

What is the IUPAC name of 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol?
The IUPAC name of 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol (CID 130146305) is 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol.
What is the SMILES notation for 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol?
The canonical SMILES for 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol is CN1C2CCCC1(C)CC(O)C2.
What is the InChIKey of 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol?
The InChIKey is CYXOCSCFUDBIQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-10-5-3-4-8(11(10)2)6-9(12)7-10/h8-9,12H,3-7H2,1-2H3.
What are the key properties of 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol?
1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol has a molecular weight of 169.27 g/mol, XLogP of 1.38, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,9-dimethyl-9-azabicyclo[3.3.1]nonan-3-ol is sourced from PubChem (CID 130146305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).