8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane

C9H16F2N2 — CID 157032814

IUPAC8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane
SMILESCC(C)N1CC(F)(F)C2(CNC2)C1
InChIInChI=1S/C9H16F2N2/c1-7(2)13-5-8(3-12-4-8)9(10,11)6-13/h7,12H,3-6H2,1-2H3
InChIKeyITZGMIMNDUHOSN-UHFFFAOYSA-N
MW190.24 g/mol
LogP0.94
Rot. Bonds1

About 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane

8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane (PubChem CID 157032814) has the molecular formula C9H16F2N2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane.

Molecular Properties

Compound Name8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane
PubChem CID157032814
Molecular FormulaC9H16F2N2
Molecular Weight190.24 g/mol
Exact Mass190.13
IUPAC Name8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane
SMILESCC(C)N1CC(F)(F)C2(CNC2)C1
InChIInChI=1S/C9H16F2N2/c1-7(2)13-5-8(3-12-4-8)9(10,11)6-13/h7,12H,3-6H2,1-2H3
InChIKeyITZGMIMNDUHOSN-UHFFFAOYSA-N
XLogP0.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;2-propan-2-yl-2,6-diazaspiro[3.3]heptane
CID 160577480
(5S)-6,6-difluoro-2-propan-2-yl-2,9-diazaspiro[4.5]decane;methane
CID 167531970
3,3,4-trifluoro-4-methyl-1-propan-2-ylpyrrolidine
CID 159310583
(1R,5R)-1,5-dimethyl-3-propan-2-yl-3,7-diazabicyclo[3.3.1]nonane
CID 98114726
2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane
CID 20781150
ethane;8-ethyl-6,6-difluoro-2-propan-2-yl-2,8-diazaspiro[4.5]decane
CID 176558131
3-fluoro-1-propan-2-yl-3-(trifluoromethyl)azetidine
CID 166826440
ethane;(3-fluoro-1-propan-2-ylazetidin-3-yl)methanol
CID 168906490
6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane
CID 156813146
12-propan-2-yl-12-azapentacyclo[6.5.1.13,10.01,10.03,8]pentadecane
CID 129118439
5,5-difluoro-2,7-di(propan-2-yl)-2,7-diazaspiro[3.5]nonane;ethane;3-ethyl-9-methyl-3-azaspiro[5.5]undecane
CID 177029011
ethane;2,2,6,6-tetramethyl-4-propan-2-ylmorpholine
CID 178173229

Frequently Asked Questions

What is the IUPAC name of 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane?
The IUPAC name of 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane (CID 157032814) is 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane.
What is the SMILES notation for 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane?
The canonical SMILES for 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane is CC(C)N1CC(F)(F)C2(CNC2)C1.
What is the InChIKey of 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane?
The InChIKey is ITZGMIMNDUHOSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F2N2/c1-7(2)13-5-8(3-12-4-8)9(10,11)6-13/h7,12H,3-6H2,1-2H3.
What are the key properties of 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane?
8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane has a molecular weight of 190.24 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-difluoro-6-propan-2-yl-2,6-diazaspiro[3.4]octane is sourced from PubChem (CID 157032814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).