4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane

C12H25N3O2S — CID 43598113

IUPAC4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane
SMILESCN(C)S(=O)(=O)NC1CCNC2(CCCCC2)C1
InChIInChI=1S/C12H25N3O2S/c1-15(2)18(16,17)14-11-6-9-13-12(10-11)7-4-3-5-8-12/h11,13-14H,3-10H2,1-2H3
InChIKeyMDCYLZJJMQPXJU-UHFFFAOYSA-N
MW275.42 g/mol
LogP0.84
Rot. Bonds3

About 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane

4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane (PubChem CID 43598113) has the molecular formula C12H25N3O2S and a molecular weight of 275.42 g/mol. Its IUPAC name is 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane.

Molecular Properties

Compound Name4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane
PubChem CID43598113
Molecular FormulaC12H25N3O2S
Molecular Weight275.42 g/mol
Exact Mass275.17
IUPAC Name4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane
SMILESCN(C)S(=O)(=O)NC1CCNC2(CCCCC2)C1
InChIInChI=1S/C12H25N3O2S/c1-15(2)18(16,17)14-11-6-9-13-12(10-11)7-4-3-5-8-12/h11,13-14H,3-10H2,1-2H3
InChIKeyMDCYLZJJMQPXJU-UHFFFAOYSA-N
XLogP0.84
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Azaspiro(5.5)undecan-4-amine
CID 64981405
3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-sulfonamide
CID 91642856
4-[(4,4-Difluorocyclohexyl)methyl-sulfamoylamino]piperidine
CID 167049362
N-(1-azaspiro[5.5]undecan-4-yl)-1,1,1-trifluoromethanesulfonamide
CID 43598115
N-(2,2,2-trifluoroethylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine
CID 114810366
3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide
CID 42894521
2,2,6,6-Tetramethyl-4-(sulfinatoamino)piperidine
CID 17912142
2-(1-Piperidin-4-ylpropyl)-1,2,6-thiadiazinane 1,1-dioxide
CID 20434924
(1S)-1-cyclohexyl-N'-(dimethylsulfamoyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine
CID 58821835
4-[2-[Cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine
CID 70551613
4-[2-[[Cyclohexyl(methyl)sulfamoyl]amino]ethyl]piperidine
CID 70585175
4-Ethyl-2-methyl-3-(3-methylbutyl)-1,2,6-thiadiazinane 1,1-dioxide
CID 118241953

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane?
The IUPAC name of 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane (CID 43598113) is 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane.
What is the SMILES notation for 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane?
The canonical SMILES for 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane is CN(C)S(=O)(=O)NC1CCNC2(CCCCC2)C1.
What is the InChIKey of 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane?
The InChIKey is MDCYLZJJMQPXJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S/c1-15(2)18(16,17)14-11-6-9-13-12(10-11)7-4-3-5-8-12/h11,13-14H,3-10H2,1-2H3.
What are the key properties of 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane?
4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane has a molecular weight of 275.42 g/mol, XLogP of 0.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoylamino)-1-azaspiro[5.5]undecane is sourced from PubChem (CID 43598113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).