9,9-difluoro-2-azaspiro[4.4]nonane

C8H13F2N — CID 83670267

IUPAC9,9-difluoro-2-azaspiro[4.4]nonane
SMILESFC1(F)CCCC12CCNC2
InChIInChI=1S/C8H13F2N/c9-8(10)3-1-2-7(8)4-5-11-6-7/h11H,1-6H2
InChIKeyHQENERCVLGYTRL-UHFFFAOYSA-N
MW161.19 g/mol
LogP1.79
Rot. Bonds

About 9,9-difluoro-2-azaspiro[4.4]nonane

9,9-difluoro-2-azaspiro[4.4]nonane (PubChem CID 83670267) has the molecular formula C8H13F2N and a molecular weight of 161.19 g/mol. Its IUPAC name is 9,9-difluoro-2-azaspiro[4.4]nonane.

Molecular Properties

Compound Name9,9-difluoro-2-azaspiro[4.4]nonane
PubChem CID83670267
Molecular FormulaC8H13F2N
Molecular Weight161.19 g/mol
Exact Mass161.10
IUPAC Name9,9-difluoro-2-azaspiro[4.4]nonane
SMILESFC1(F)CCCC12CCNC2
InChIInChI=1S/C8H13F2N/c9-8(10)3-1-2-7(8)4-5-11-6-7/h11H,1-6H2
InChIKeyHQENERCVLGYTRL-UHFFFAOYSA-N
XLogP1.79
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.19
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9,9-difluoro-2-azaspiro[4.4]nonane?
The IUPAC name of 9,9-difluoro-2-azaspiro[4.4]nonane (CID 83670267) is 9,9-difluoro-2-azaspiro[4.4]nonane.
What is the SMILES notation for 9,9-difluoro-2-azaspiro[4.4]nonane?
The canonical SMILES for 9,9-difluoro-2-azaspiro[4.4]nonane is FC1(F)CCCC12CCNC2.
What is the InChIKey of 9,9-difluoro-2-azaspiro[4.4]nonane?
The InChIKey is HQENERCVLGYTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2N/c9-8(10)3-1-2-7(8)4-5-11-6-7/h11H,1-6H2.
What are the key properties of 9,9-difluoro-2-azaspiro[4.4]nonane?
9,9-difluoro-2-azaspiro[4.4]nonane has a molecular weight of 161.19 g/mol, XLogP of 1.79, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-difluoro-2-azaspiro[4.4]nonane is sourced from PubChem (CID 83670267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).