9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride

C9H18ClNO — CID 86010304

IUPAC9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride
SMILESCN1C2CCCC1CC(O)C2.Cl
InChIInChI=1S/C9H17NO.ClH/c1-10-7-3-2-4-8(10)6-9(11)5-7;/h7-9,11H,2-6H2,1H3;1H
InChIKeyHIXYALRNLOELPP-UHFFFAOYSA-N
MW191.70 g/mol
LogP1.42
Rot. Bonds

About 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride

9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride (PubChem CID 86010304) has the molecular formula C9H18ClNO and a molecular weight of 191.70 g/mol. Its IUPAC name is 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride.

Molecular Properties

Compound Name9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride
PubChem CID86010304
Molecular FormulaC9H18ClNO
Molecular Weight191.70 g/mol
Exact Mass191.11
IUPAC Name9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride
SMILESCN1C2CCCC1CC(O)C2.Cl
InChIInChI=1S/C9H17NO.ClH/c1-10-7-3-2-4-8(10)6-9(11)5-7;/h7-9,11H,2-6H2,1H3;1H
InChIKeyHIXYALRNLOELPP-UHFFFAOYSA-N
XLogP1.42
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.70
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride?
The IUPAC name of 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride (CID 86010304) is 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride.
What is the SMILES notation for 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride?
The canonical SMILES for 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride is CN1C2CCCC1CC(O)C2.Cl.
What is the InChIKey of 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride?
The InChIKey is HIXYALRNLOELPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO.ClH/c1-10-7-3-2-4-8(10)6-9(11)5-7;/h7-9,11H,2-6H2,1H3;1H.
What are the key properties of 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride?
9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride has a molecular weight of 191.70 g/mol, XLogP of 1.42, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-9-azabicyclo[3.3.1]nonan-3-ol;hydrochloride is sourced from PubChem (CID 86010304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).