5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane

C11H20F2N2 — CID 155044370

IUPAC5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane
SMILESCC(C)N1CC2(CCN(C)CC2(F)F)C1
InChIInChI=1S/C11H20F2N2/c1-9(2)15-6-10(7-15)4-5-14(3)8-11(10,12)13/h9H,4-8H2,1-3H3
InChIKeyPWCLFNAFGBJUKY-UHFFFAOYSA-N
MW218.29 g/mol
LogP1.67
Rot. Bonds1

About 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane

5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane (PubChem CID 155044370) has the molecular formula C11H20F2N2 and a molecular weight of 218.29 g/mol. Its IUPAC name is 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane
PubChem CID155044370
Molecular FormulaC11H20F2N2
Molecular Weight218.29 g/mol
Exact Mass218.16
IUPAC Name5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane
SMILESCC(C)N1CC2(CCN(C)CC2(F)F)C1
InChIInChI=1S/C11H20F2N2/c1-9(2)15-6-10(7-15)4-5-14(3)8-11(10,12)13/h9H,4-8H2,1-3H3
InChIKeyPWCLFNAFGBJUKY-UHFFFAOYSA-N
XLogP1.67
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.29
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane?
The IUPAC name of 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane (CID 155044370) is 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane?
The canonical SMILES for 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane is CC(C)N1CC2(CCN(C)CC2(F)F)C1.
What is the InChIKey of 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane?
The InChIKey is PWCLFNAFGBJUKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F2N2/c1-9(2)15-6-10(7-15)4-5-14(3)8-11(10,12)13/h9H,4-8H2,1-3H3.
What are the key properties of 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane?
5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane has a molecular weight of 218.29 g/mol, XLogP of 1.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-difluoro-7-methyl-2-propan-2-yl-2,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 155044370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).