11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane

C13H24F2N2 — CID 64871559

IUPAC11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane
SMILESCC1CCNC2(CCCCC2)CN1CC(F)F
InChIInChI=1S/C13H24F2N2/c1-11-5-8-16-13(6-3-2-4-7-13)10-17(11)9-12(14)15/h11-12,16H,2-10H2,1H3
InChIKeyHMDWVGFWMFBCDZ-UHFFFAOYSA-N
MW246.34 g/mol
LogP2.64
Rot. Bonds2

About 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane

11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane (PubChem CID 64871559) has the molecular formula C13H24F2N2 and a molecular weight of 246.34 g/mol. Its IUPAC name is 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane
PubChem CID64871559
Molecular FormulaC13H24F2N2
Molecular Weight246.34 g/mol
Exact Mass246.19
IUPAC Name11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane
SMILESCC1CCNC2(CCCCC2)CN1CC(F)F
InChIInChI=1S/C13H24F2N2/c1-11-5-8-16-13(6-3-2-4-7-13)10-17(11)9-12(14)15/h11-12,16H,2-10H2,1H3
InChIKeyHMDWVGFWMFBCDZ-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.34
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

10-methyl-11-(2,2,2-trifluoroethyl)-7,11-diazaspiro[5.6]dodecane
CID 64871366
10-methyl-11-propyl-7,11-diazaspiro[5.6]dodecane
CID 64870179
10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 81113015
10-methyl-11-[2-(trifluoromethylsulfanyl)ethyl]-7,11-diazaspiro[5.6]dodecane
CID 116627590
9-methyl-10-(3-methylbut-2-enyl)-6,10-diazaspiro[4.6]undecane
CID 114014155
3-methyl-4-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64877798
10-(2-ethylsulfonylethyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 106733398
9-methyl-10-(2-propan-2-ylsulfonylethyl)-6,10-diazaspiro[4.6]undecane
CID 106733400
9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane
CID 106458879
10-methyl-11-(3-methylsulfonylpropyl)-7,11-diazaspiro[5.6]dodecane
CID 64869383
10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 65178467
10-(3-ethylsulfanylpropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 113474602

Frequently Asked Questions

What is the IUPAC name of 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane?
The IUPAC name of 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane (CID 64871559) is 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane.
What is the SMILES notation for 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane?
The canonical SMILES for 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane is CC1CCNC2(CCCCC2)CN1CC(F)F.
What is the InChIKey of 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane?
The InChIKey is HMDWVGFWMFBCDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24F2N2/c1-11-5-8-16-13(6-3-2-4-7-13)10-17(11)9-12(14)15/h11-12,16H,2-10H2,1H3.
What are the key properties of 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane?
11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane has a molecular weight of 246.34 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane is sourced from PubChem (CID 64871559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).