2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol

C9H17NO2 — CID 166894539

IUPAC2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol
SMILESOCCCN1CC2(CC(O)C2)C1
InChIInChI=1S/C9H17NO2/c11-3-1-2-10-6-9(7-10)4-8(12)5-9/h8,11-12H,1-7H2
InChIKeyFGBGCEYXTSDCEG-UHFFFAOYSA-N
MW171.24 g/mol
LogP-0.17
Rot. Bonds3

About 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol

2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol (PubChem CID 166894539) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol.

Molecular Properties

Compound Name2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol
PubChem CID166894539
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol
SMILESOCCCN1CC2(CC(O)C2)C1
InChIInChI=1S/C9H17NO2/c11-3-1-2-10-6-9(7-10)4-8(12)5-9/h8,11-12H,1-7H2
InChIKeyFGBGCEYXTSDCEG-UHFFFAOYSA-N
XLogP-0.17
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-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 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol?
The IUPAC name of 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol (CID 166894539) is 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol.
What is the SMILES notation for 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol?
The canonical SMILES for 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol is OCCCN1CC2(CC(O)C2)C1.
What is the InChIKey of 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol?
The InChIKey is FGBGCEYXTSDCEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c11-3-1-2-10-6-9(7-10)4-8(12)5-9/h8,11-12H,1-7H2.
What are the key properties of 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol?
2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol has a molecular weight of 171.24 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxypropyl)-2-azaspiro[3.3]heptan-6-ol is sourced from PubChem (CID 166894539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).