5-azaspiro[2.4]heptan-7-ol;hydrochloride

C6H12ClNO — CID 66935992

IUPAC5-azaspiro[2.4]heptan-7-ol;hydrochloride
SMILESCl.OC1CNCC12CC2
InChIInChI=1S/C6H11NO.ClH/c8-5-3-7-4-6(5)1-2-6;/h5,7-8H,1-4H2;1H
InChIKeyYLIIGIXSYBKPGM-UHFFFAOYSA-N
MW149.62 g/mol
LogP0.15
Rot. Bonds

About 5-azaspiro[2.4]heptan-7-ol;hydrochloride

5-azaspiro[2.4]heptan-7-ol;hydrochloride (PubChem CID 66935992) has the molecular formula C6H12ClNO and a molecular weight of 149.62 g/mol. Its IUPAC name is 5-azaspiro[2.4]heptan-7-ol;hydrochloride.

Molecular Properties

Compound Name5-azaspiro[2.4]heptan-7-ol;hydrochloride
PubChem CID66935992
Molecular FormulaC6H12ClNO
Molecular Weight149.62 g/mol
Exact Mass149.06
IUPAC Name5-azaspiro[2.4]heptan-7-ol;hydrochloride
SMILESCl.OC1CNCC12CC2
InChIInChI=1S/C6H11NO.ClH/c8-5-3-7-4-6(5)1-2-6;/h5,7-8H,1-4H2;1H
InChIKeyYLIIGIXSYBKPGM-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 5-azaspiro[2.4]heptan-7-ol;hydrochloride?
The IUPAC name of 5-azaspiro[2.4]heptan-7-ol;hydrochloride (CID 66935992) is 5-azaspiro[2.4]heptan-7-ol;hydrochloride.
What is the SMILES notation for 5-azaspiro[2.4]heptan-7-ol;hydrochloride?
The canonical SMILES for 5-azaspiro[2.4]heptan-7-ol;hydrochloride is Cl.OC1CNCC12CC2.
What is the InChIKey of 5-azaspiro[2.4]heptan-7-ol;hydrochloride?
The InChIKey is YLIIGIXSYBKPGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.ClH/c8-5-3-7-4-6(5)1-2-6;/h5,7-8H,1-4H2;1H.
What are the key properties of 5-azaspiro[2.4]heptan-7-ol;hydrochloride?
5-azaspiro[2.4]heptan-7-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 5-azaspiro[2.4]heptan-7-ol;hydrochloride is sourced from PubChem (CID 66935992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).