N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide

C11H24N2O2S — CID 143744840

IUPACN-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide
SMILESC=CS(=O)(=O)N(C)CCCCCCN(C)C
InChIInChI=1S/C11H24N2O2S/c1-5-16(14,15)13(4)11-9-7-6-8-10-12(2)3/h5H,1,6-11H2,2-4H3
InChIKeyMJWFHMYYOWSTPE-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.51
Rot. Bonds9

About N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide

N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide (PubChem CID 143744840) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide
PubChem CID143744840
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide
SMILESC=CS(=O)(=O)N(C)CCCCCCN(C)C
InChIInChI=1S/C11H24N2O2S/c1-5-16(14,15)13(4)11-9-7-6-8-10-12(2)3/h5H,1,6-11H2,2-4H3
InChIKeyMJWFHMYYOWSTPE-UHFFFAOYSA-N
XLogP1.51
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

acetaldehyde;N,N-dimethylhexan-1-amine;formaldehyde
CID 170732723
N,N,N',N'-tetramethylpentane-1,5-diamine;dihydrobromide
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27-(dimethylamino)heptacos-1-en-3-one
CID 139647791
bis(N,N-dimethylnonadecan-1-amine);sulfuric acid
CID 175167546
N,N,N',N'-tetramethylbutane-1,4-diamine;dihydrochloride
CID 20545505
N-[3-(dimethylamino)propyl]-N-methylprop-2-enamide;hydrazine
CID 162091587
N-methyl-N-pent-4-enylmethanesulfonamide
CID 115640453
N,N-dipropylethenesulfonamide
CID 22164671
8-(dimethylamino)octylsulfanyl hydrogen sulfate
CID 141348794
[dihydroxy(oxo)-λ6-sulfanylidene]-[6-(dimethylamino)hexyl]sulfanium
CID 172712303
N,N-dimethyloctadecan-1-amine;3-prop-2-enoxyprop-1-ene
CID 166644636
N,N-dimethyloctan-1-amine
CID 161279104

Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide?
The IUPAC name of N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide (CID 143744840) is N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide.
What is the SMILES notation for N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide?
The canonical SMILES for N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide is C=CS(=O)(=O)N(C)CCCCCCN(C)C.
What is the InChIKey of N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide?
The InChIKey is MJWFHMYYOWSTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-5-16(14,15)13(4)11-9-7-6-8-10-12(2)3/h5H,1,6-11H2,2-4H3.
What are the key properties of N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide?
N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide has a molecular weight of 248.39 g/mol, XLogP of 1.51, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)hexyl]-N-methylethenesulfonamide is sourced from PubChem (CID 143744840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).