2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide

C7H14F3N3O3S — CID 106336586

IUPAC2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide
SMILESCNS(=O)(=O)CCNC(=O)C(C)(N)C(F)(F)F
InChIInChI=1S/C7H14F3N3O3S/c1-6(11,7(8,9)10)5(14)13-3-4-17(15,16)12-2/h12H,3-4,11H2,1-2H3,(H,13,14)
InChIKeyZTQGITVRSIRFFW-UHFFFAOYSA-N
MW277.27 g/mol
LogP-1.07
Rot. Bonds5

About 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide

2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide (PubChem CID 106336586) has the molecular formula C7H14F3N3O3S and a molecular weight of 277.27 g/mol. Its IUPAC name is 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide.

Molecular Properties

Compound Name2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide
PubChem CID106336586
Molecular FormulaC7H14F3N3O3S
Molecular Weight277.27 g/mol
Exact Mass277.07
IUPAC Name2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide
SMILESCNS(=O)(=O)CCNC(=O)C(C)(N)C(F)(F)F
InChIInChI=1S/C7H14F3N3O3S/c1-6(11,7(8,9)10)5(14)13-3-4-17(15,16)12-2/h12H,3-4,11H2,1-2H3,(H,13,14)
InChIKeyZTQGITVRSIRFFW-UHFFFAOYSA-N
XLogP-1.07
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 5-1.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide?
The IUPAC name of 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide (CID 106336586) is 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide.
What is the SMILES notation for 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide?
The canonical SMILES for 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide is CNS(=O)(=O)CCNC(=O)C(C)(N)C(F)(F)F.
What is the InChIKey of 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide?
The InChIKey is ZTQGITVRSIRFFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3N3O3S/c1-6(11,7(8,9)10)5(14)13-3-4-17(15,16)12-2/h12H,3-4,11H2,1-2H3,(H,13,14).
What are the key properties of 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide?
2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide has a molecular weight of 277.27 g/mol, XLogP of -1.07, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)ethyl]propanamide is sourced from PubChem (CID 106336586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).