azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide

C7H16N2O2S — CID 118160596

IUPACazane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide
SMILESN.O=S1(=O)CCC2(CC1)CNC2
InChIInChI=1S/C7H13NO2S.H3N/c9-11(10)3-1-7(2-4-11)5-8-6-7;/h8H,1-6H2;1H3
InChIKeyAIKFNOFCGXMCFS-UHFFFAOYSA-N
MW192.28 g/mol
LogP-0.05
Rot. Bonds

About azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide

azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide (PubChem CID 118160596) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide.

Molecular Properties

Compound Nameazane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide
PubChem CID118160596
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC Nameazane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide
SMILESN.O=S1(=O)CCC2(CC1)CNC2
InChIInChI=1S/C7H13NO2S.H3N/c9-11(10)3-1-7(2-4-11)5-8-6-7;/h8H,1-6H2;1H3
InChIKeyAIKFNOFCGXMCFS-UHFFFAOYSA-N
XLogP-0.05
TPSA81.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide?
The IUPAC name of azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide (CID 118160596) is azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide.
What is the SMILES notation for azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide?
The canonical SMILES for azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide is N.O=S1(=O)CCC2(CC1)CNC2.
What is the InChIKey of azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide?
The InChIKey is AIKFNOFCGXMCFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2S.H3N/c9-11(10)3-1-7(2-4-11)5-8-6-7;/h8H,1-6H2;1H3.
What are the key properties of azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide?
azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide has a molecular weight of 192.28 g/mol, XLogP of -0.05, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;7λ6-thia-2-azaspiro[3.5]nonane 7,7-dioxide is sourced from PubChem (CID 118160596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).