N,2,4-trimethylazetidine-1-sulfonamide

C6H14N2O2S — CID 126990130

IUPACN,2,4-trimethylazetidine-1-sulfonamide
SMILESCNS(=O)(=O)N1C(C)CC1C
InChIInChI=1S/C6H14N2O2S/c1-5-4-6(2)8(5)11(9,10)7-3/h5-7H,4H2,1-3H3
InChIKeyXHTRMJLOOUXKCZ-UHFFFAOYSA-N
MW178.26 g/mol
LogP-0.07
Rot. Bonds2

About N,2,4-trimethylazetidine-1-sulfonamide

N,2,4-trimethylazetidine-1-sulfonamide (PubChem CID 126990130) has the molecular formula C6H14N2O2S and a molecular weight of 178.26 g/mol. Its IUPAC name is N,2,4-trimethylazetidine-1-sulfonamide.

Molecular Properties

Compound NameN,2,4-trimethylazetidine-1-sulfonamide
PubChem CID126990130
Molecular FormulaC6H14N2O2S
Molecular Weight178.26 g/mol
Exact Mass178.08
IUPAC NameN,2,4-trimethylazetidine-1-sulfonamide
SMILESCNS(=O)(=O)N1C(C)CC1C
InChIInChI=1S/C6H14N2O2S/c1-5-4-6(2)8(5)11(9,10)7-3/h5-7H,4H2,1-3H3
InChIKeyXHTRMJLOOUXKCZ-UHFFFAOYSA-N
XLogP-0.07
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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N-methylazepane-1-sulfonamide
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4-methyl-1-(methylsulfamoyl)piperidine-2-carboxylic acid
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CID 130933962
N-ethyl-2-methyl-3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrole-1-sulfonamide
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2-fluoro-N-methylpyrrolidine-1-sulfonamide
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CID 59999333
N-methylpiperazine-1-sulfonamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of N,2,4-trimethylazetidine-1-sulfonamide?
The IUPAC name of N,2,4-trimethylazetidine-1-sulfonamide (CID 126990130) is N,2,4-trimethylazetidine-1-sulfonamide.
What is the SMILES notation for N,2,4-trimethylazetidine-1-sulfonamide?
The canonical SMILES for N,2,4-trimethylazetidine-1-sulfonamide is CNS(=O)(=O)N1C(C)CC1C.
What is the InChIKey of N,2,4-trimethylazetidine-1-sulfonamide?
The InChIKey is XHTRMJLOOUXKCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2S/c1-5-4-6(2)8(5)11(9,10)7-3/h5-7H,4H2,1-3H3.
What are the key properties of N,2,4-trimethylazetidine-1-sulfonamide?
N,2,4-trimethylazetidine-1-sulfonamide has a molecular weight of 178.26 g/mol, XLogP of -0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,4-trimethylazetidine-1-sulfonamide is sourced from PubChem (CID 126990130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).