N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide

C10H22N2O2S — CID 105420670

IUPACN-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide
SMILESCCS(=O)(=O)N(C)CC1(N(C)C)CCC1
InChIInChI=1S/C10H22N2O2S/c1-5-15(13,14)12(4)9-10(11(2)3)7-6-8-10/h5-9H2,1-4H3
InChIKeyBHWPJDXABKZBNL-UHFFFAOYSA-N
MW234.36 g/mol
LogP0.75
Rot. Bonds5

About N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide

N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide (PubChem CID 105420670) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide
PubChem CID105420670
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC NameN-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide
SMILESCCS(=O)(=O)N(C)CC1(N(C)C)CCC1
InChIInChI=1S/C10H22N2O2S/c1-5-15(13,14)12(4)9-10(11(2)3)7-6-8-10/h5-9H2,1-4H3
InChIKeyBHWPJDXABKZBNL-UHFFFAOYSA-N
XLogP0.75
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-4-(propan-2-ylamino)butane-1-sulfonamide
CID 105421445
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-1-piperidin-2-ylmethanesulfonamide
CID 105419208
N-[(1-hydroxycyclopentyl)methyl]-N-methylethanesulfonamide
CID 115867632
N'-[[1-(dimethylamino)cyclobutyl]methyl-methylsulfamoyl]-N'-methylpropane-1,3-diamine
CID 105416138
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylpiperazine-1-sulfonamide
CID 105415384
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-1-(propan-2-ylamino)propane-2-sulfonamide
CID 105421428
2-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylbenzenesulfonamide
CID 105416124
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-(hydroxymethyl)-N-methylbenzenesulfonamide
CID 105421404
N,N-dimethyl-1-[[methyl(propan-2-yl)amino]methyl]cyclobutan-1-amine
CID 176568551
3-amino-4-chloro-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylbenzenesulfonamide
CID 105413736
N-methyl-N-[[1-(propan-2-ylamino)cyclohexyl]methyl]ethanesulfonamide
CID 58821714
4-bromo-2-chloro-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylbenzenesulfonamide
CID 105420154

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide?
The IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide (CID 105420670) is N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide.
What is the SMILES notation for N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide?
The canonical SMILES for N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide is CCS(=O)(=O)N(C)CC1(N(C)C)CCC1.
What is the InChIKey of N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide?
The InChIKey is BHWPJDXABKZBNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-5-15(13,14)12(4)9-10(11(2)3)7-6-8-10/h5-9H2,1-4H3.
What are the key properties of N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide?
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide has a molecular weight of 234.36 g/mol, XLogP of 0.75, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methylethanesulfonamide is sourced from PubChem (CID 105420670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).