1-ethoxy-2-[methyl(sulfamoyl)amino]ethane

C5H14N2O3S — CID 81062689

IUPAC1-ethoxy-2-[methyl(sulfamoyl)amino]ethane
SMILESCCOCCN(C)S(N)(=O)=O
InChIInChI=1S/C5H14N2O3S/c1-3-10-5-4-7(2)11(6,8)9/h3-5H2,1-2H3,(H2,6,8,9)
InChIKeyOBUNBEFPHFMSIW-UHFFFAOYSA-N
MW182.24 g/mol
LogP-0.84
Rot. Bonds5

About 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane

1-ethoxy-2-[methyl(sulfamoyl)amino]ethane (PubChem CID 81062689) has the molecular formula C5H14N2O3S and a molecular weight of 182.24 g/mol. Its IUPAC name is 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane.

Molecular Properties

Compound Name1-ethoxy-2-[methyl(sulfamoyl)amino]ethane
PubChem CID81062689
Molecular FormulaC5H14N2O3S
Molecular Weight182.24 g/mol
Exact Mass182.07
IUPAC Name1-ethoxy-2-[methyl(sulfamoyl)amino]ethane
SMILESCCOCCN(C)S(N)(=O)=O
InChIInChI=1S/C5H14N2O3S/c1-3-10-5-4-7(2)11(6,8)9/h3-5H2,1-2H3,(H2,6,8,9)
InChIKeyOBUNBEFPHFMSIW-UHFFFAOYSA-N
XLogP-0.84
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 5-0.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane?
The IUPAC name of 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane (CID 81062689) is 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane.
What is the SMILES notation for 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane?
The canonical SMILES for 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane is CCOCCN(C)S(N)(=O)=O.
What is the InChIKey of 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane?
The InChIKey is OBUNBEFPHFMSIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O3S/c1-3-10-5-4-7(2)11(6,8)9/h3-5H2,1-2H3,(H2,6,8,9).
What are the key properties of 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane?
1-ethoxy-2-[methyl(sulfamoyl)amino]ethane has a molecular weight of 182.24 g/mol, XLogP of -0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-2-[methyl(sulfamoyl)amino]ethane is sourced from PubChem (CID 81062689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).