5-azaspiro[2.4]heptan-7-ol

C6H11NO — CID 16738286

IUPAC5-azaspiro[2.4]heptan-7-ol
SMILESOC1CNCC12CC2
InChIInChI=1S/C6H11NO/c8-5-3-7-4-6(5)1-2-6/h5,7-8H,1-4H2
InChIKeyBHIQRZLQBMERJY-UHFFFAOYSA-N
MW113.16 g/mol
LogP-0.27
Rot. Bonds

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

5-azaspiro[2.4]heptan-7-ol (PubChem CID 16738286) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 5-azaspiro[2.4]heptan-7-ol.

Molecular Properties

Compound Name5-azaspiro[2.4]heptan-7-ol
PubChem CID16738286
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name5-azaspiro[2.4]heptan-7-ol
SMILESOC1CNCC12CC2
InChIInChI=1S/C6H11NO/c8-5-3-7-4-6(5)1-2-6/h5,7-8H,1-4H2
InChIKeyBHIQRZLQBMERJY-UHFFFAOYSA-N
XLogP-0.27
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 5-0.27
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?
The IUPAC name of 5-azaspiro[2.4]heptan-7-ol (CID 16738286) is 5-azaspiro[2.4]heptan-7-ol.
What is the SMILES notation for 5-azaspiro[2.4]heptan-7-ol?
The canonical SMILES for 5-azaspiro[2.4]heptan-7-ol is OC1CNCC12CC2.
What is the InChIKey of 5-azaspiro[2.4]heptan-7-ol?
The InChIKey is BHIQRZLQBMERJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c8-5-3-7-4-6(5)1-2-6/h5,7-8H,1-4H2.
What are the key properties of 5-azaspiro[2.4]heptan-7-ol?
5-azaspiro[2.4]heptan-7-ol has a molecular weight of 113.16 g/mol, XLogP of -0.27, 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 is sourced from PubChem (CID 16738286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).