2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol

C10H24N2O3S — CID 61425365

IUPAC2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol
SMILESCCCCN(C)S(=O)(=O)N(CCC)CCO
InChIInChI=1S/C10H24N2O3S/c1-4-6-8-11(3)16(14,15)12(7-5-2)9-10-13/h13H,4-10H2,1-3H3
InChIKeyCPSXJXFWPVTGSR-UHFFFAOYSA-N
MW252.38 g/mol
LogP0.67
Rot. Bonds9

About 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol

2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol (PubChem CID 61425365) has the molecular formula C10H24N2O3S and a molecular weight of 252.38 g/mol. Its IUPAC name is 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol.

Molecular Properties

Compound Name2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol
PubChem CID61425365
Molecular FormulaC10H24N2O3S
Molecular Weight252.38 g/mol
Exact Mass252.15
IUPAC Name2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol
SMILESCCCCN(C)S(=O)(=O)N(CCC)CCO
InChIInChI=1S/C10H24N2O3S/c1-4-6-8-11(3)16(14,15)12(7-5-2)9-10-13/h13H,4-10H2,1-3H3
InChIKeyCPSXJXFWPVTGSR-UHFFFAOYSA-N
XLogP0.67
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol?
The IUPAC name of 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol (CID 61425365) is 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol.
What is the SMILES notation for 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol?
The canonical SMILES for 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol is CCCCN(C)S(=O)(=O)N(CCC)CCO.
What is the InChIKey of 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol?
The InChIKey is CPSXJXFWPVTGSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3S/c1-4-6-8-11(3)16(14,15)12(7-5-2)9-10-13/h13H,4-10H2,1-3H3.
What are the key properties of 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol?
2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol has a molecular weight of 252.38 g/mol, XLogP of 0.67, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[butyl(methyl)sulfamoyl]-propylamino]ethanol is sourced from PubChem (CID 61425365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).