1-[diethylsulfamoyl(methyl)amino]propan-2-ol

C8H20N2O3S — CID 62333345

IUPAC1-[diethylsulfamoyl(methyl)amino]propan-2-ol
SMILESCCN(CC)S(=O)(=O)N(C)CC(C)O
InChIInChI=1S/C8H20N2O3S/c1-5-10(6-2)14(12,13)9(4)7-8(3)11/h8,11H,5-7H2,1-4H3
InChIKeyJEWPMRYKSYWNGQ-UHFFFAOYSA-N
MW224.33 g/mol
LogP-0.11
Rot. Bonds6

About 1-[diethylsulfamoyl(methyl)amino]propan-2-ol

1-[diethylsulfamoyl(methyl)amino]propan-2-ol (PubChem CID 62333345) has the molecular formula C8H20N2O3S and a molecular weight of 224.33 g/mol. Its IUPAC name is 1-[diethylsulfamoyl(methyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[diethylsulfamoyl(methyl)amino]propan-2-ol
PubChem CID62333345
Molecular FormulaC8H20N2O3S
Molecular Weight224.33 g/mol
Exact Mass224.12
IUPAC Name1-[diethylsulfamoyl(methyl)amino]propan-2-ol
SMILESCCN(CC)S(=O)(=O)N(C)CC(C)O
InChIInChI=1S/C8H20N2O3S/c1-5-10(6-2)14(12,13)9(4)7-8(3)11/h8,11H,5-7H2,1-4H3
InChIKeyJEWPMRYKSYWNGQ-UHFFFAOYSA-N
XLogP-0.11
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[diethylsulfamoyl(methyl)amino]propan-2-ol?
The IUPAC name of 1-[diethylsulfamoyl(methyl)amino]propan-2-ol (CID 62333345) is 1-[diethylsulfamoyl(methyl)amino]propan-2-ol.
What is the SMILES notation for 1-[diethylsulfamoyl(methyl)amino]propan-2-ol?
The canonical SMILES for 1-[diethylsulfamoyl(methyl)amino]propan-2-ol is CCN(CC)S(=O)(=O)N(C)CC(C)O.
What is the InChIKey of 1-[diethylsulfamoyl(methyl)amino]propan-2-ol?
The InChIKey is JEWPMRYKSYWNGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O3S/c1-5-10(6-2)14(12,13)9(4)7-8(3)11/h8,11H,5-7H2,1-4H3.
What are the key properties of 1-[diethylsulfamoyl(methyl)amino]propan-2-ol?
1-[diethylsulfamoyl(methyl)amino]propan-2-ol has a molecular weight of 224.33 g/mol, XLogP of -0.11, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[diethylsulfamoyl(methyl)amino]propan-2-ol is sourced from PubChem (CID 62333345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).