8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol

C9H15F2NO — CID 123504573

IUPAC8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol
SMILESOC1CNC2(CC2)C(CC(F)F)C1
InChIInChI=1S/C9H15F2NO/c10-8(11)4-6-3-7(13)5-12-9(6)1-2-9/h6-8,12-13H,1-5H2
InChIKeySNIWJVPCDBPLTI-UHFFFAOYSA-N
MW191.22 g/mol
LogP1.14
Rot. Bonds2

About 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol

8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol (PubChem CID 123504573) has the molecular formula C9H15F2NO and a molecular weight of 191.22 g/mol. Its IUPAC name is 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol.

Molecular Properties

Compound Name8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol
PubChem CID123504573
Molecular FormulaC9H15F2NO
Molecular Weight191.22 g/mol
Exact Mass191.11
IUPAC Name8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol
SMILESOC1CNC2(CC2)C(CC(F)F)C1
InChIInChI=1S/C9H15F2NO/c10-8(11)4-6-3-7(13)5-12-9(6)1-2-9/h6-8,12-13H,1-5H2
InChIKeySNIWJVPCDBPLTI-UHFFFAOYSA-N
XLogP1.14
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.22
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-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 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol?
The IUPAC name of 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol (CID 123504573) is 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol.
What is the SMILES notation for 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol?
The canonical SMILES for 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol is OC1CNC2(CC2)C(CC(F)F)C1.
What is the InChIKey of 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol?
The InChIKey is SNIWJVPCDBPLTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2NO/c10-8(11)4-6-3-7(13)5-12-9(6)1-2-9/h6-8,12-13H,1-5H2.
What are the key properties of 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol?
8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol has a molecular weight of 191.22 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,2-difluoroethyl)-4-azaspiro[2.5]octan-6-ol is sourced from PubChem (CID 123504573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).