(sulfamoylamino)ethane;2,2,2-trifluoroacetic acid

C4H9F3N2O4S — CID 175933782

IUPAC(sulfamoylamino)ethane;2,2,2-trifluoroacetic acid
SMILESCCNS(N)(=O)=O.O=C(O)C(F)(F)F
InChIInChI=1S/C2HF3O2.C2H8N2O2S/c3-2(4,5)1(6)7;1-2-4-7(3,5)6/h(H,6,7);4H,2H2,1H3,(H2,3,5,6)
InChIKeyPYZVOPACVDDBGR-UHFFFAOYSA-N
MW238.19 g/mol
LogP-0.57
Rot. Bonds2

About (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid

(sulfamoylamino)ethane;2,2,2-trifluoroacetic acid (PubChem CID 175933782) has the molecular formula C4H9F3N2O4S and a molecular weight of 238.19 g/mol. Its IUPAC name is (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Name(sulfamoylamino)ethane;2,2,2-trifluoroacetic acid
PubChem CID175933782
Molecular FormulaC4H9F3N2O4S
Molecular Weight238.19 g/mol
Exact Mass238.02
IUPAC Name(sulfamoylamino)ethane;2,2,2-trifluoroacetic acid
SMILESCCNS(N)(=O)=O.O=C(O)C(F)(F)F
InChIInChI=1S/C2HF3O2.C2H8N2O2S/c3-2(4,5)1(6)7;1-2-4-7(3,5)6/h(H,6,7);4H,2H2,1H3,(H2,3,5,6)
InChIKeyPYZVOPACVDDBGR-UHFFFAOYSA-N
XLogP-0.57
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.19
LogP ≤ 5-0.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid with MolForge

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

Launch Full Analysis

Related Compounds

N-butylthiohydroxylamine;2,2,2-trifluoroacetic acid
CID 88317843
1-Amino-3-(sulfinatoamino)propane;2,2,2-trifluoroacetic acid
CID 137376499
N-(2-Aminoethyl)methanesulfonamide trifluoroacetate
CID 137376504
3-Aminopropylsulfamoyl 2,2,2-trifluoroacetate
CID 141489984
(1-Aminoethoxysulfamoylamino) 2,2,2-trifluoroacetate
CID 141512773
Ethane-1,1-diamine;bis(2,2,2-trifluoroacetic acid)
CID 141912308
1-Amino-2-(sulfamoylamino)ethane;2,2,2-trifluoroacetic acid
CID 175728490
1-(Sulfamoylamino)propane;2,2,2-trifluoroacetic acid
CID 175933781
2-(2,2,2-Trifluoroethylsulfamoylamino)acetic acid
CID 114805142
3-(2,2,2-Trifluoroethylsulfamoylamino)propanoic acid
CID 114805153
acetic acid;N-ethylsulfamoyl fluoride
CID 175435767
2-(Ethylsulfamoylamino)acetic acid
CID 115776563

Frequently Asked Questions

What is the IUPAC name of (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid?
The IUPAC name of (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid (CID 175933782) is (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid.
What is the SMILES notation for (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid?
The canonical SMILES for (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid is CCNS(N)(=O)=O.O=C(O)C(F)(F)F.
What is the InChIKey of (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid?
The InChIKey is PYZVOPACVDDBGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C2HF3O2.C2H8N2O2S/c3-2(4,5)1(6)7;1-2-4-7(3,5)6/h(H,6,7);4H,2H2,1H3,(H2,3,5,6).
What are the key properties of (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid?
(sulfamoylamino)ethane;2,2,2-trifluoroacetic acid has a molecular weight of 238.19 g/mol, XLogP of -0.57, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (sulfamoylamino)ethane;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 175933782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).