1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane

C8H17F3N2O3S — CID 114809703

IUPAC1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane
SMILESCCN(CC(C)(C)O)S(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C8H17F3N2O3S/c1-4-13(6-7(2,3)14)17(15,16)12-5-8(9,10)11/h12,14H,4-6H2,1-3H3
InChIKeyNKCTTYNJCFCSCP-UHFFFAOYSA-N
MW278.30 g/mol
LogP0.48
Rot. Bonds6

About 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane

1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane (PubChem CID 114809703) has the molecular formula C8H17F3N2O3S and a molecular weight of 278.30 g/mol. Its IUPAC name is 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane.

Molecular Properties

Compound Name1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane
PubChem CID114809703
Molecular FormulaC8H17F3N2O3S
Molecular Weight278.30 g/mol
Exact Mass278.09
IUPAC Name1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane
SMILESCCN(CC(C)(C)O)S(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C8H17F3N2O3S/c1-4-13(6-7(2,3)14)17(15,16)12-5-8(9,10)11/h12,14H,4-6H2,1-3H3
InChIKeyNKCTTYNJCFCSCP-UHFFFAOYSA-N
XLogP0.48
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.30
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane?
The IUPAC name of 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane (CID 114809703) is 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane.
What is the SMILES notation for 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane?
The canonical SMILES for 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane is CCN(CC(C)(C)O)S(=O)(=O)NCC(F)(F)F.
What is the InChIKey of 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane?
The InChIKey is NKCTTYNJCFCSCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17F3N2O3S/c1-4-13(6-7(2,3)14)17(15,16)12-5-8(9,10)11/h12,14H,4-6H2,1-3H3.
What are the key properties of 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane?
1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane has a molecular weight of 278.30 g/mol, XLogP of 0.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]-2-hydroxy-2-methylpropane is sourced from PubChem (CID 114809703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).