6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride

C15H22ClNO2 — CID 67870695

IUPAC6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride
SMILESCOc1ccccc1C1CCN2CCC(O)C1C2.Cl
InChIInChI=1S/C15H21NO2.ClH/c1-18-15-5-3-2-4-12(15)11-6-8-16-9-7-14(17)13(11)10-16;/h2-5,11,13-14,17H,6-10H2,1H3;1H
InChIKeyNQHZVJNXIJIDPP-UHFFFAOYSA-N
MW283.80 g/mol
LogP2.29
Rot. Bonds2

About 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride

6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride (PubChem CID 67870695) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride.

Molecular Properties

Compound Name6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride
PubChem CID67870695
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC Name6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride
SMILESCOc1ccccc1C1CCN2CCC(O)C1C2.Cl
InChIInChI=1S/C15H21NO2.ClH/c1-18-15-5-3-2-4-12(15)11-6-8-16-9-7-14(17)13(11)10-16;/h2-5,11,13-14,17H,6-10H2,1H3;1H
InChIKeyNQHZVJNXIJIDPP-UHFFFAOYSA-N
XLogP2.29
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride?
The IUPAC name of 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride (CID 67870695) is 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride.
What is the SMILES notation for 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride?
The canonical SMILES for 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride is COc1ccccc1C1CCN2CCC(O)C1C2.Cl.
What is the InChIKey of 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride?
The InChIKey is NQHZVJNXIJIDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2.ClH/c1-18-15-5-3-2-4-12(15)11-6-8-16-9-7-14(17)13(11)10-16;/h2-5,11,13-14,17H,6-10H2,1H3;1H.
What are the key properties of 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride?
6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride has a molecular weight of 283.80 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyphenyl)-1-azabicyclo[3.3.1]nonan-4-ol;hydrochloride is sourced from PubChem (CID 67870695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).