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

C11H26N2O3S — CID 61447920

IUPAC2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol
SMILESCCCCN(C)S(=O)(=O)N(CCO)CCCC
InChIInChI=1S/C11H26N2O3S/c1-4-6-8-12(3)17(15,16)13(10-11-14)9-7-5-2/h14H,4-11H2,1-3H3
InChIKeyYATHTRLDKRFDRB-UHFFFAOYSA-N
MW266.41 g/mol
LogP1.06
Rot. Bonds10

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

2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol (PubChem CID 61447920) has the molecular formula C11H26N2O3S and a molecular weight of 266.41 g/mol. Its IUPAC name is 2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol.

Molecular Properties

Compound Name2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol
PubChem CID61447920
Molecular FormulaC11H26N2O3S
Molecular Weight266.41 g/mol
Exact Mass266.17
IUPAC Name2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol
SMILESCCCCN(C)S(=O)(=O)N(CCO)CCCC
InChIInChI=1S/C11H26N2O3S/c1-4-6-8-12(3)17(15,16)13(10-11-14)9-7-5-2/h14H,4-11H2,1-3H3
InChIKeyYATHTRLDKRFDRB-UHFFFAOYSA-N
XLogP1.06
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol?
The IUPAC name of 2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol (CID 61447920) is 2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol.
What is the SMILES notation for 2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol?
The canonical SMILES for 2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol is CCCCN(C)S(=O)(=O)N(CCO)CCCC.
What is the InChIKey of 2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol?
The InChIKey is YATHTRLDKRFDRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O3S/c1-4-6-8-12(3)17(15,16)13(10-11-14)9-7-5-2/h14H,4-11H2,1-3H3.
What are the key properties of 2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol?
2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol has a molecular weight of 266.41 g/mol, XLogP of 1.06, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl-[butyl(methyl)sulfamoyl]amino]ethanol is sourced from PubChem (CID 61447920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).