8,8-difluoro-6-azaspiro[3.4]octan-2-ol

C7H11F2NO — CID 177186304

IUPAC8,8-difluoro-6-azaspiro[3.4]octan-2-ol
SMILESOC1CC2(CNCC2(F)F)C1
InChIInChI=1S/C7H11F2NO/c8-7(9)4-10-3-6(7)1-5(11)2-6/h5,10-11H,1-4H2
InChIKeyNSVWDPZIZPCDDG-UHFFFAOYSA-N
MW163.17 g/mol
LogP0.37
Rot. Bonds

About 8,8-difluoro-6-azaspiro[3.4]octan-2-ol

8,8-difluoro-6-azaspiro[3.4]octan-2-ol (PubChem CID 177186304) has the molecular formula C7H11F2NO and a molecular weight of 163.17 g/mol. Its IUPAC name is 8,8-difluoro-6-azaspiro[3.4]octan-2-ol.

Molecular Properties

Compound Name8,8-difluoro-6-azaspiro[3.4]octan-2-ol
PubChem CID177186304
Molecular FormulaC7H11F2NO
Molecular Weight163.17 g/mol
Exact Mass163.08
IUPAC Name8,8-difluoro-6-azaspiro[3.4]octan-2-ol
SMILESOC1CC2(CNCC2(F)F)C1
InChIInChI=1S/C7H11F2NO/c8-7(9)4-10-3-6(7)1-5(11)2-6/h5,10-11H,1-4H2
InChIKeyNSVWDPZIZPCDDG-UHFFFAOYSA-N
XLogP0.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.17
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-Azaspiro(3.4)octan-2-ol hydrochloride
CID 122622398
6-Azaspiro(3.4)octan-1-ol hydrochloride
CID 138106352
2-(Trifluoromethyl)-6-azaspiro[3.4]octan-2-ol hydrochloride
CID 178199972
6-Azaspiro[3.4]octan-2-ol
CID 122458917
6-Azaspiro[3.4]octan-1-ol
CID 122458919
6-Azaspiro[3.4]octan-2-ol;2,2,2-trifluoroacetic acid
CID 175919585
1,1,1-Trifluoro-3-pyrrolidin-3-ylpropan-2-ol
CID 84732502
1,1-Difluoro-1-pyrrolidin-3-ylpropan-2-ol
CID 105432622
1-Fluoro-3-(pyrrolidin-3-yl)propan-2-ol
CID 131006720
3,3,3-Trifluoro-1-(3-methylpyrrolidin-3-yl)propan-1-ol
CID 148568567
2-(Trifluoromethyl)-6-azaspiro[3.4]octan-2-ol
CID 178199973
6-Azaspiro[3.4]octan-2-ol;methane
CID 169236562

Frequently Asked Questions

What is the IUPAC name of 8,8-difluoro-6-azaspiro[3.4]octan-2-ol?
The IUPAC name of 8,8-difluoro-6-azaspiro[3.4]octan-2-ol (CID 177186304) is 8,8-difluoro-6-azaspiro[3.4]octan-2-ol.
What is the SMILES notation for 8,8-difluoro-6-azaspiro[3.4]octan-2-ol?
The canonical SMILES for 8,8-difluoro-6-azaspiro[3.4]octan-2-ol is OC1CC2(CNCC2(F)F)C1.
What is the InChIKey of 8,8-difluoro-6-azaspiro[3.4]octan-2-ol?
The InChIKey is NSVWDPZIZPCDDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2NO/c8-7(9)4-10-3-6(7)1-5(11)2-6/h5,10-11H,1-4H2.
What are the key properties of 8,8-difluoro-6-azaspiro[3.4]octan-2-ol?
8,8-difluoro-6-azaspiro[3.4]octan-2-ol has a molecular weight of 163.17 g/mol, XLogP of 0.37, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-difluoro-6-azaspiro[3.4]octan-2-ol is sourced from PubChem (CID 177186304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).