2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride

C7H12ClF2NO — CID 146155810

IUPAC2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride
SMILESCl.FC1(F)CC12CNCCOC2
InChIInChI=1S/C7H11F2NO.ClH/c8-7(9)3-6(7)4-10-1-2-11-5-6;/h10H,1-5H2;1H
InChIKeyVFVJQTXLHONBHC-UHFFFAOYSA-N
MW199.63 g/mol
LogP1.05
Rot. Bonds

About 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride

2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride (PubChem CID 146155810) has the molecular formula C7H12ClF2NO and a molecular weight of 199.63 g/mol. Its IUPAC name is 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride.

Molecular Properties

Compound Name2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride
PubChem CID146155810
Molecular FormulaC7H12ClF2NO
Molecular Weight199.63 g/mol
Exact Mass199.06
IUPAC Name2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride
SMILESCl.FC1(F)CC12CNCCOC2
InChIInChI=1S/C7H11F2NO.ClH/c8-7(9)3-6(7)4-10-1-2-11-5-6;/h10H,1-5H2;1H
InChIKeyVFVJQTXLHONBHC-UHFFFAOYSA-N
XLogP1.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.63
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 87713044
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morpholine;sulfane
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1,4,7-trioxa-10-azacyclododecane
CID 545817
10-oxa-1,7-diazaspiro[4.6]undecane
CID 118210142
1,10-dioxa-7-azaspiro[4.6]undecane
CID 118210191
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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride?
The IUPAC name of 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride (CID 146155810) is 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride.
What is the SMILES notation for 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride?
The canonical SMILES for 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride is Cl.FC1(F)CC12CNCCOC2.
What is the InChIKey of 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride?
The InChIKey is VFVJQTXLHONBHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F2NO.ClH/c8-7(9)3-6(7)4-10-1-2-11-5-6;/h10H,1-5H2;1H.
What are the key properties of 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride?
2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride has a molecular weight of 199.63 g/mol, XLogP of 1.05, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-5-oxa-8-azaspiro[2.6]nonane;hydrochloride is sourced from PubChem (CID 146155810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).