11,11-difluoro-3-azaspiro[5.5]undecane

C10H17F2N — CID 135392962

IUPAC11,11-difluoro-3-azaspiro[5.5]undecane
SMILESFC1(F)CCCCC12CCNCC2
InChIInChI=1S/C10H17F2N/c11-10(12)4-2-1-3-9(10)5-7-13-8-6-9/h13H,1-8H2
InChIKeySSPIXHJYDMBPCA-UHFFFAOYSA-N
MW189.25 g/mol
LogP2.57
Rot. Bonds

About 11,11-difluoro-3-azaspiro[5.5]undecane

11,11-difluoro-3-azaspiro[5.5]undecane (PubChem CID 135392962) has the molecular formula C10H17F2N and a molecular weight of 189.25 g/mol. Its IUPAC name is 11,11-difluoro-3-azaspiro[5.5]undecane.

Molecular Properties

Compound Name11,11-difluoro-3-azaspiro[5.5]undecane
PubChem CID135392962
Molecular FormulaC10H17F2N
Molecular Weight189.25 g/mol
Exact Mass189.13
IUPAC Name11,11-difluoro-3-azaspiro[5.5]undecane
SMILESFC1(F)CCCCC12CCNCC2
InChIInChI=1S/C10H17F2N/c11-10(12)4-2-1-3-9(10)5-7-13-8-6-9/h13H,1-8H2
InChIKeySSPIXHJYDMBPCA-UHFFFAOYSA-N
XLogP2.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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6-azadispiro[2.0.44.43]dodecane
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4,4-difluoropiperidine;methane
CID 143607085
5,5-difluoro-2-methyl-2,7-diazaspiro[3.5]nonane;dihydrochloride
CID 155895873
ethane;4-fluoro-4-methylpiperidine
CID 142139578
11-azadispiro[4.2.58.25]pentadecane
CID 114820262
2-(2,2-dimethylpropyl)-5,5-difluoro-2,9-diazaspiro[5.5]undecane
CID 170064018
2-ethyl-5,5-difluoro-2,7-diazaspiro[3.5]nonane
CID 175631153
6,6-difluoro-2-methyl-2,9-diazaspiro[4.5]decane
CID 129230219
2,8-diazaspiro[4.5]decane;ethane
CID 143048064
1,1,2,2-tetrafluoro-6-azaspiro[2.5]octane;hydrochloride
CID 122163593

Frequently Asked Questions

What is the IUPAC name of 11,11-difluoro-3-azaspiro[5.5]undecane?
The IUPAC name of 11,11-difluoro-3-azaspiro[5.5]undecane (CID 135392962) is 11,11-difluoro-3-azaspiro[5.5]undecane.
What is the SMILES notation for 11,11-difluoro-3-azaspiro[5.5]undecane?
The canonical SMILES for 11,11-difluoro-3-azaspiro[5.5]undecane is FC1(F)CCCCC12CCNCC2.
What is the InChIKey of 11,11-difluoro-3-azaspiro[5.5]undecane?
The InChIKey is SSPIXHJYDMBPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F2N/c11-10(12)4-2-1-3-9(10)5-7-13-8-6-9/h13H,1-8H2.
What are the key properties of 11,11-difluoro-3-azaspiro[5.5]undecane?
11,11-difluoro-3-azaspiro[5.5]undecane has a molecular weight of 189.25 g/mol, XLogP of 2.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-difluoro-3-azaspiro[5.5]undecane is sourced from PubChem (CID 135392962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).