5-azaspiro[3.4]octan-2-ol

C7H13NO — CID 166638472

IUPAC5-azaspiro[3.4]octan-2-ol
SMILESOC1CC2(CCCN2)C1
InChIInChI=1S/C7H13NO/c9-6-4-7(5-6)2-1-3-8-7/h6,8-9H,1-5H2
InChIKeyBMJFRLMJUGDIFJ-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.26
Rot. Bonds

About 5-azaspiro[3.4]octan-2-ol

5-azaspiro[3.4]octan-2-ol (PubChem CID 166638472) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 5-azaspiro[3.4]octan-2-ol.

Molecular Properties

Compound Name5-azaspiro[3.4]octan-2-ol
PubChem CID166638472
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name5-azaspiro[3.4]octan-2-ol
SMILESOC1CC2(CCCN2)C1
InChIInChI=1S/C7H13NO/c9-6-4-7(5-6)2-1-3-8-7/h6,8-9H,1-5H2
InChIKeyBMJFRLMJUGDIFJ-UHFFFAOYSA-N
XLogP0.26
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-azaspiro[3.4]octan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-azaspiro[3.4]octan-2-ol?
The IUPAC name of 5-azaspiro[3.4]octan-2-ol (CID 166638472) is 5-azaspiro[3.4]octan-2-ol.
What is the SMILES notation for 5-azaspiro[3.4]octan-2-ol?
The canonical SMILES for 5-azaspiro[3.4]octan-2-ol is OC1CC2(CCCN2)C1.
What is the InChIKey of 5-azaspiro[3.4]octan-2-ol?
The InChIKey is BMJFRLMJUGDIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c9-6-4-7(5-6)2-1-3-8-7/h6,8-9H,1-5H2.
What are the key properties of 5-azaspiro[3.4]octan-2-ol?
5-azaspiro[3.4]octan-2-ol has a molecular weight of 127.19 g/mol, XLogP of 0.26, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-azaspiro[3.4]octan-2-ol is sourced from PubChem (CID 166638472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).