[ethyl(methylsulfamoyl)amino]ethane

C5H14N2O2S — CID 12699427

IUPAC[ethyl(methylsulfamoyl)amino]ethane
SMILESCCN(CC)S(=O)(=O)NC
InChIInChI=1S/C5H14N2O2S/c1-4-7(5-2)10(8,9)6-3/h6H,4-5H2,1-3H3
InChIKeyZDCLYRCPRVRWDU-UHFFFAOYSA-N
MW166.25 g/mol
LogP-0.21
Rot. Bonds4

About [ethyl(methylsulfamoyl)amino]ethane

[ethyl(methylsulfamoyl)amino]ethane (PubChem CID 12699427) has the molecular formula C5H14N2O2S and a molecular weight of 166.25 g/mol. Its IUPAC name is [ethyl(methylsulfamoyl)amino]ethane.

Molecular Properties

Compound Name[ethyl(methylsulfamoyl)amino]ethane
PubChem CID12699427
Molecular FormulaC5H14N2O2S
Molecular Weight166.25 g/mol
Exact Mass166.08
IUPAC Name[ethyl(methylsulfamoyl)amino]ethane
SMILESCCN(CC)S(=O)(=O)NC
InChIInChI=1S/C5H14N2O2S/c1-4-7(5-2)10(8,9)6-3/h6H,4-5H2,1-3H3
InChIKeyZDCLYRCPRVRWDU-UHFFFAOYSA-N
XLogP-0.21
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [ethyl(methylsulfamoyl)amino]ethane?
The IUPAC name of [ethyl(methylsulfamoyl)amino]ethane (CID 12699427) is [ethyl(methylsulfamoyl)amino]ethane.
What is the SMILES notation for [ethyl(methylsulfamoyl)amino]ethane?
The canonical SMILES for [ethyl(methylsulfamoyl)amino]ethane is CCN(CC)S(=O)(=O)NC.
What is the InChIKey of [ethyl(methylsulfamoyl)amino]ethane?
The InChIKey is ZDCLYRCPRVRWDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O2S/c1-4-7(5-2)10(8,9)6-3/h6H,4-5H2,1-3H3.
What are the key properties of [ethyl(methylsulfamoyl)amino]ethane?
[ethyl(methylsulfamoyl)amino]ethane has a molecular weight of 166.25 g/mol, XLogP of -0.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [ethyl(methylsulfamoyl)amino]ethane is sourced from PubChem (CID 12699427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).