8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane

C15H30N2O2S — CID 65097005

IUPAC8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane
SMILESCCC1CN(CCCS(=O)(=O)CC)C2(CCCC2)CN1
InChIInChI=1S/C15H30N2O2S/c1-3-14-12-17(10-7-11-20(18,19)4-2)15(13-16-14)8-5-6-9-15/h14,16H,3-13H2,1-2H3
InChIKeyHURXFHCWRVVGRS-UHFFFAOYSA-N
MW302.48 g/mol
LogP1.81
Rot. Bonds6

About 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane

8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane (PubChem CID 65097005) has the molecular formula C15H30N2O2S and a molecular weight of 302.48 g/mol. Its IUPAC name is 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane
PubChem CID65097005
Molecular FormulaC15H30N2O2S
Molecular Weight302.48 g/mol
Exact Mass302.20
IUPAC Name8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane
SMILESCCC1CN(CCCS(=O)(=O)CC)C2(CCCC2)CN1
InChIInChI=1S/C15H30N2O2S/c1-3-14-12-17(10-7-11-20(18,19)4-2)15(13-16-14)8-5-6-9-15/h14,16H,3-13H2,1-2H3
InChIKeyHURXFHCWRVVGRS-UHFFFAOYSA-N
XLogP1.81
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.48
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-ethyl-6-(3-fluoropropyl)-6,9-diazaspiro[4.5]decane
CID 81114428
8-ethyl-6-(2-propan-2-ylsulfonylethyl)-6,9-diazaspiro[4.5]decane
CID 106733011
3-ethyl-1-octyl-1,4-diazaspiro[5.5]undecane
CID 64843543
6-(2-ethylsulfonylethyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 106732813
3-ethyl-1-(2-fluoroethyl)-1,4-diazaspiro[5.5]undecane
CID 80697421
6-butyl-8-propyl-6,9-diazaspiro[4.5]decane
CID 64838046
3-cyclopropyl-1-(2-ethylsulfonylethyl)-1,4-diazaspiro[5.5]undecane
CID 106733303
1-(2-ethylsulfonylethyl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 106732916
3-ethyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazaspiro[5.5]undecane
CID 64842964
8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane
CID 64847996
1-butyl-3-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64848961
3-methyl-1-(2-methylsulfonylethyl)-1,4-diazaspiro[5.5]undecane
CID 64844749

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane (CID 65097005) is 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane is CCC1CN(CCCS(=O)(=O)CC)C2(CCCC2)CN1.
What is the InChIKey of 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane?
The InChIKey is HURXFHCWRVVGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2S/c1-3-14-12-17(10-7-11-20(18,19)4-2)15(13-16-14)8-5-6-9-15/h14,16H,3-13H2,1-2H3.
What are the key properties of 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane?
8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane has a molecular weight of 302.48 g/mol, XLogP of 1.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-6-(3-ethylsulfonylpropyl)-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 65097005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).