8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane

C11H22N2O2S — CID 115276469

IUPAC8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane
SMILESCC(C)S(=O)(=O)N1CCC2(CCNC2)CC1
InChIInChI=1S/C11H22N2O2S/c1-10(2)16(14,15)13-7-4-11(5-8-13)3-6-12-9-11/h10,12H,3-9H2,1-2H3
InChIKeyLYOSBFDMECDKRF-UHFFFAOYSA-N
MW246.38 g/mol
LogP0.80
Rot. Bonds2

About 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane

8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane (PubChem CID 115276469) has the molecular formula C11H22N2O2S and a molecular weight of 246.38 g/mol. Its IUPAC name is 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane
PubChem CID115276469
Molecular FormulaC11H22N2O2S
Molecular Weight246.38 g/mol
Exact Mass246.14
IUPAC Name8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane
SMILESCC(C)S(=O)(=O)N1CCC2(CCNC2)CC1
InChIInChI=1S/C11H22N2O2S/c1-10(2)16(14,15)13-7-4-11(5-8-13)3-6-12-9-11/h10,12H,3-9H2,1-2H3
InChIKeyLYOSBFDMECDKRF-UHFFFAOYSA-N
XLogP0.80
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(6R)-2-propan-2-ylsulfonyl-2,8-diazaspiro[5.5]undecane
CID 97449155
8-propylsulfonyl-2,8-diazaspiro[4.5]decane;hydrochloride
CID 169490463
6-propan-2-ylsulfonyl-6-azaspiro[3.4]octane
CID 130815616
2-ethyl-7-propan-2-ylsulfonyl-7-azaspiro[3.5]nonane
CID 175627410
8-(3,5-dichlorophenyl)sulfonyl-2,8-diazaspiro[4.5]decane
CID 67480503
1-propan-2-ylsulfonylimidazolidine
CID 118937794
1-(2,7-diazaspiro[4.4]nonan-2-yl)-2-methylpropan-1-one;hydrochloride
CID 169493333
3,3-dimethyl-1-propan-2-ylsulfonylpiperazine
CID 82994561
2-propan-2-yl-2,7-diazaspiro[4.4]nonane
CID 58821247
2,8-diazaspiro[4.5]decane;ethane
CID 143048064
8-ethyl-2,8-diazaspiro[4.5]decane
CID 46318290
potassium;2,8-diazaspiro[4.5]decan-8-ylmethanone;ethane
CID 164876170

Frequently Asked Questions

What is the IUPAC name of 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane (CID 115276469) is 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane is CC(C)S(=O)(=O)N1CCC2(CCNC2)CC1.
What is the InChIKey of 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane?
The InChIKey is LYOSBFDMECDKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2S/c1-10(2)16(14,15)13-7-4-11(5-8-13)3-6-12-9-11/h10,12H,3-9H2,1-2H3.
What are the key properties of 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane?
8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane has a molecular weight of 246.38 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-ylsulfonyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 115276469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).