N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine

C5H11F3N2O2S — CID 114807157

IUPACN-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine
SMILESCC(C)NS(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C5H11F3N2O2S/c1-4(2)10-13(11,12)9-3-5(6,7)8/h4,9-10H,3H2,1-2H3
InChIKeyMJXWYTTWCLLIBZ-UHFFFAOYSA-N
MW220.22 g/mol
LogP0.38
Rot. Bonds4

About N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine

N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine (PubChem CID 114807157) has the molecular formula C5H11F3N2O2S and a molecular weight of 220.22 g/mol. Its IUPAC name is N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine.

Molecular Properties

Compound NameN-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine
PubChem CID114807157
Molecular FormulaC5H11F3N2O2S
Molecular Weight220.22 g/mol
Exact Mass220.05
IUPAC NameN-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine
SMILESCC(C)NS(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C5H11F3N2O2S/c1-4(2)10-13(11,12)9-3-5(6,7)8/h4,9-10H,3H2,1-2H3
InChIKeyMJXWYTTWCLLIBZ-UHFFFAOYSA-N
XLogP0.38
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.22
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine?
The IUPAC name of N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine (CID 114807157) is N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine.
What is the SMILES notation for N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine?
The canonical SMILES for N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine is CC(C)NS(=O)(=O)NCC(F)(F)F.
What is the InChIKey of N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine?
The InChIKey is MJXWYTTWCLLIBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11F3N2O2S/c1-4(2)10-13(11,12)9-3-5(6,7)8/h4,9-10H,3H2,1-2H3.
What are the key properties of N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine?
N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine has a molecular weight of 220.22 g/mol, XLogP of 0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,2-trifluoroethylsulfamoyl)propan-2-amine is sourced from PubChem (CID 114807157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).