4,4-difluoro-1-azaspiro[4.4]nonane

C8H13F2N — CID 83856346

IUPAC4,4-difluoro-1-azaspiro[4.4]nonane
SMILESFC1(F)CCNC12CCCC2
InChIInChI=1S/C8H13F2N/c9-8(10)5-6-11-7(8)3-1-2-4-7/h11H,1-6H2
InChIKeyXPNZYCAVSLZBLW-UHFFFAOYSA-N
MW161.19 g/mol
LogP1.93
Rot. Bonds

About 4,4-difluoro-1-azaspiro[4.4]nonane

4,4-difluoro-1-azaspiro[4.4]nonane (PubChem CID 83856346) has the molecular formula C8H13F2N and a molecular weight of 161.19 g/mol. Its IUPAC name is 4,4-difluoro-1-azaspiro[4.4]nonane.

Molecular Properties

Compound Name4,4-difluoro-1-azaspiro[4.4]nonane
PubChem CID83856346
Molecular FormulaC8H13F2N
Molecular Weight161.19 g/mol
Exact Mass161.10
IUPAC Name4,4-difluoro-1-azaspiro[4.4]nonane
SMILESFC1(F)CCNC12CCCC2
InChIInChI=1S/C8H13F2N/c9-8(10)5-6-11-7(8)3-1-2-4-7/h11H,1-6H2
InChIKeyXPNZYCAVSLZBLW-UHFFFAOYSA-N
XLogP1.93
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 ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5,5-difluoro-1-azaspiro[5.6]dodecane
CID 155973408
7,7-difluoro-1-azaspiro[3.3]heptane;hydrochloride
CID 155896929
4,4-difluoro-8λ6-thia-1-azaspiro[4.5]decane 8,8-dioxide
CID 115034951
3-azadispiro[3.0.55.34]tridecane
CID 130646295
3,3-difluoro-1,8-diazaspiro[3.5]nonane
CID 88978072
2,2-difluoroazetidine
CID 68750416
2-bromo-2-fluoro-4-azaspiro[2.4]heptane
CID 146598189
3,3-difluoro-2,2-dimethylpyrrolidine;hydrochloride
CID 115013960
tert-butyl 4,4-difluoro-1,8-diazaspiro[4.5]decane-8-carboxylate;hydrochloride
CID 115053505
2-tert-butyl-3,3-difluoro-2-methylpyrrolidine
CID 83855284
(5R)-7,10-dioxa-4-azadispiro[4.0.46.45]tetradecane
CID 10607983
2,2-difluoro-5-azaspiro[3.5]nonane
CID 155892857

Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-1-azaspiro[4.4]nonane?
The IUPAC name of 4,4-difluoro-1-azaspiro[4.4]nonane (CID 83856346) is 4,4-difluoro-1-azaspiro[4.4]nonane.
What is the SMILES notation for 4,4-difluoro-1-azaspiro[4.4]nonane?
The canonical SMILES for 4,4-difluoro-1-azaspiro[4.4]nonane is FC1(F)CCNC12CCCC2.
What is the InChIKey of 4,4-difluoro-1-azaspiro[4.4]nonane?
The InChIKey is XPNZYCAVSLZBLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2N/c9-8(10)5-6-11-7(8)3-1-2-4-7/h11H,1-6H2.
What are the key properties of 4,4-difluoro-1-azaspiro[4.4]nonane?
4,4-difluoro-1-azaspiro[4.4]nonane has a molecular weight of 161.19 g/mol, XLogP of 1.93, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-1-azaspiro[4.4]nonane is sourced from PubChem (CID 83856346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).