2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride

C8H14ClF2N — CID 163197098

IUPAC2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride
SMILESCl.FC1(F)CC2(CCCNC2)C1
InChIInChI=1S/C8H13F2N.ClH/c9-8(10)4-7(5-8)2-1-3-11-6-7;/h11H,1-6H2;1H
InChIKeyODRRFSPFTAURAB-UHFFFAOYSA-N
MW197.66 g/mol
LogP2.21
Rot. Bonds

About 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride

2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride (PubChem CID 163197098) has the molecular formula C8H14ClF2N and a molecular weight of 197.66 g/mol. Its IUPAC name is 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride.

Molecular Properties

Compound Name2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride
PubChem CID163197098
Molecular FormulaC8H14ClF2N
Molecular Weight197.66 g/mol
Exact Mass197.08
IUPAC Name2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride
SMILESCl.FC1(F)CC2(CCCNC2)C1
InChIInChI=1S/C8H13F2N.ClH/c9-8(10)4-7(5-8)2-1-3-11-6-7;/h11H,1-6H2;1H
InChIKeyODRRFSPFTAURAB-UHFFFAOYSA-N
XLogP2.21
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.66
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 66586168
3,3-difluoroazepane;ethane
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2-oxa-8-azaspiro[5.5]undecane;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride?
The IUPAC name of 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride (CID 163197098) is 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride.
What is the SMILES notation for 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride?
The canonical SMILES for 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride is Cl.FC1(F)CC2(CCCNC2)C1.
What is the InChIKey of 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride?
The InChIKey is ODRRFSPFTAURAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2N.ClH/c9-8(10)4-7(5-8)2-1-3-11-6-7;/h11H,1-6H2;1H.
What are the key properties of 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride?
2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride has a molecular weight of 197.66 g/mol, XLogP of 2.21, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-6-azaspiro[3.5]nonane;hydrochloride is sourced from PubChem (CID 163197098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).