2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride

C6H12ClNO — CID 23294138

IUPAC2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride
SMILESCl.OC1CC2CNC1C2
InChIInChI=1S/C6H11NO.ClH/c8-6-2-4-1-5(6)7-3-4;/h4-8H,1-3H2;1H
InChIKeyHTTUWXPQGHCWCO-UHFFFAOYSA-N
MW149.62 g/mol
LogP0.15
Rot. Bonds

About 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride

2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride (PubChem CID 23294138) has the molecular formula C6H12ClNO and a molecular weight of 149.62 g/mol. Its IUPAC name is 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride.

Molecular Properties

Compound Name2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride
PubChem CID23294138
Molecular FormulaC6H12ClNO
Molecular Weight149.62 g/mol
Exact Mass149.06
IUPAC Name2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride
SMILESCl.OC1CC2CNC1C2
InChIInChI=1S/C6H11NO.ClH/c8-6-2-4-1-5(6)7-3-4;/h4-8H,1-3H2;1H
InChIKeyHTTUWXPQGHCWCO-UHFFFAOYSA-N
XLogP0.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.62
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride?
The IUPAC name of 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride (CID 23294138) is 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride.
What is the SMILES notation for 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride?
The canonical SMILES for 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride is Cl.OC1CC2CNC1C2.
What is the InChIKey of 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride?
The InChIKey is HTTUWXPQGHCWCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.ClH/c8-6-2-4-1-5(6)7-3-4;/h4-8H,1-3H2;1H.
What are the key properties of 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride?
2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride has a molecular weight of 149.62 g/mol, XLogP of 0.15, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azabicyclo[2.2.1]heptan-6-ol;hydrochloride is sourced from PubChem (CID 23294138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).