2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide

C6H8F2N2O — CID 166920454

IUPAC2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide
SMILESNC(=O)N1CC2(C1)CC2(F)F
InChIInChI=1S/C6H8F2N2O/c7-6(8)1-5(6)2-10(3-5)4(9)11/h1-3H2,(H2,9,11)
InChIKeyVBBSIFGLYDUYHF-UHFFFAOYSA-N
MW162.14 g/mol
LogP0.41
Rot. Bonds

About 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide

2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide (PubChem CID 166920454) has the molecular formula C6H8F2N2O and a molecular weight of 162.14 g/mol. Its IUPAC name is 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide.

Molecular Properties

Compound Name2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide
PubChem CID166920454
Molecular FormulaC6H8F2N2O
Molecular Weight162.14 g/mol
Exact Mass162.06
IUPAC Name2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide
SMILESNC(=O)N1CC2(C1)CC2(F)F
InChIInChI=1S/C6H8F2N2O/c7-6(8)1-5(6)2-10(3-5)4(9)11/h1-3H2,(H2,9,11)
InChIKeyVBBSIFGLYDUYHF-UHFFFAOYSA-N
XLogP0.41
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.14
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide 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 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide?
The IUPAC name of 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide (CID 166920454) is 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide.
What is the SMILES notation for 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide?
The canonical SMILES for 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide is NC(=O)N1CC2(C1)CC2(F)F.
What is the InChIKey of 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide?
The InChIKey is VBBSIFGLYDUYHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2N2O/c7-6(8)1-5(6)2-10(3-5)4(9)11/h1-3H2,(H2,9,11).
What are the key properties of 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide?
2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide has a molecular weight of 162.14 g/mol, XLogP of 0.41, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-5-azaspiro[2.3]hexane-5-carboxamide is sourced from PubChem (CID 166920454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).