3-ethyl-N,3-dimethylazetidine-1-sulfonamide

C7H16N2O2S — CID 130734735

IUPAC3-ethyl-N,3-dimethylazetidine-1-sulfonamide
SMILESCCC1(C)CN(S(=O)(=O)NC)C1
InChIInChI=1S/C7H16N2O2S/c1-4-7(2)5-9(6-7)12(10,11)8-3/h8H,4-6H2,1-3H3
InChIKeyIORGPHFDPBUXTG-UHFFFAOYSA-N
MW192.28 g/mol
LogP0.18
Rot. Bonds3

About 3-ethyl-N,3-dimethylazetidine-1-sulfonamide

3-ethyl-N,3-dimethylazetidine-1-sulfonamide (PubChem CID 130734735) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is 3-ethyl-N,3-dimethylazetidine-1-sulfonamide.

Molecular Properties

Compound Name3-ethyl-N,3-dimethylazetidine-1-sulfonamide
PubChem CID130734735
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC Name3-ethyl-N,3-dimethylazetidine-1-sulfonamide
SMILESCCC1(C)CN(S(=O)(=O)NC)C1
InChIInChI=1S/C7H16N2O2S/c1-4-7(2)5-9(6-7)12(10,11)8-3/h8H,4-6H2,1-3H3
InChIKeyIORGPHFDPBUXTG-UHFFFAOYSA-N
XLogP0.18
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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3-(aminomethyl)-N-ethyl-3-methylpyrrolidine-1-sulfonamide
CID 120777734
(1R,6R)-1-hydroxy-N-methyl-3-azabicyclo[4.1.0]heptane-3-sulfonamide
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3-amino-1-(methylsulfamoyl)pyrrolidine-3-carboxylic acid
CID 107324162
N-tert-butyl-3-ethyl-3-hydroxyazetidine-1-sulfonamide
CID 114809610
4-methyl-1-(methylsulfamoyl)piperidine-4-carboxamide
CID 163619342
N-methylpiperazine-1-sulfonamide;hydrochloride
CID 86812477
4-(aminomethyl)-N-methyl-4-methylsulfanylpiperidine-1-sulfonamide
CID 114804083
4-methyl-4-(methylamino)-N-propylpiperidine-1-sulfonamide
CID 114811227
N,2,6-trimethylmorpholine-4-sulfonamide
CID 43242358
3-(3-ethyl-3-methylazetidin-1-yl)-3-oxopropanenitrile
CID 130677992

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N,3-dimethylazetidine-1-sulfonamide?
The IUPAC name of 3-ethyl-N,3-dimethylazetidine-1-sulfonamide (CID 130734735) is 3-ethyl-N,3-dimethylazetidine-1-sulfonamide.
What is the SMILES notation for 3-ethyl-N,3-dimethylazetidine-1-sulfonamide?
The canonical SMILES for 3-ethyl-N,3-dimethylazetidine-1-sulfonamide is CCC1(C)CN(S(=O)(=O)NC)C1.
What is the InChIKey of 3-ethyl-N,3-dimethylazetidine-1-sulfonamide?
The InChIKey is IORGPHFDPBUXTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-4-7(2)5-9(6-7)12(10,11)8-3/h8H,4-6H2,1-3H3.
What are the key properties of 3-ethyl-N,3-dimethylazetidine-1-sulfonamide?
3-ethyl-N,3-dimethylazetidine-1-sulfonamide has a molecular weight of 192.28 g/mol, XLogP of 0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N,3-dimethylazetidine-1-sulfonamide is sourced from PubChem (CID 130734735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).