3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine

C7H14F3N3O2S — CID 114812875

IUPAC3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine
SMILESNC1CC(CNS(=O)(=O)NCC(F)(F)F)C1
InChIInChI=1S/C7H14F3N3O2S/c8-7(9,10)4-13-16(14,15)12-3-5-1-6(11)2-5/h5-6,12-13H,1-4,11H2
InChIKeyAFNTVYJKJCIRJK-UHFFFAOYSA-N
MW261.27 g/mol
LogP-0.29
Rot. Bonds5

About 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine

3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine (PubChem CID 114812875) has the molecular formula C7H14F3N3O2S and a molecular weight of 261.27 g/mol. Its IUPAC name is 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine.

Molecular Properties

Compound Name3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine
PubChem CID114812875
Molecular FormulaC7H14F3N3O2S
Molecular Weight261.27 g/mol
Exact Mass261.08
IUPAC Name3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine
SMILESNC1CC(CNS(=O)(=O)NCC(F)(F)F)C1
InChIInChI=1S/C7H14F3N3O2S/c8-7(9,10)4-13-16(14,15)12-3-5-1-6(11)2-5/h5-6,12-13H,1-4,11H2
InChIKeyAFNTVYJKJCIRJK-UHFFFAOYSA-N
XLogP-0.29
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.27
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine 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-[(3-aminocyclobutyl)methyl]-1,1-difluoromethanesulfonamide
CID 66006693
1-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine
CID 103352839
1-Amino-3-[[methyl(2,2,2-trifluoroethylsulfamoyl)amino]methyl]cyclobutane
CID 113637713
1-cyclopropyl-N-(2,2,2-trifluoroethylsulfamoyl)ethane-1,2-diamine
CID 114804056
1-cyclopropyl-N'-(2,2,2-trifluoroethylsulfamoyl)ethane-1,2-diamine
CID 114811209
1-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclobutan-1-amine
CID 114813012
1-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine;hydrochloride
CID 121673067
1-(Sulfamoylamino)-3-(trifluoromethyl)cyclobutane
CID 128389050
1,1-Difluoro-3-[(sulfamoylamino)methyl]cyclobutane
CID 128487309
N-[2-(trifluoromethyl)cyclobutyl]methanesulfonamide
CID 130662657
N-(3,3-Difluorocyclobutyl)sulfamide
CID 131175192
3-[(Methylsulfamoylamino)methyl]cyclobutan-1-amine
CID 114812877

Frequently Asked Questions

What is the IUPAC name of 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine?
The IUPAC name of 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine (CID 114812875) is 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine.
What is the SMILES notation for 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine?
The canonical SMILES for 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine is NC1CC(CNS(=O)(=O)NCC(F)(F)F)C1.
What is the InChIKey of 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine?
The InChIKey is AFNTVYJKJCIRJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3N3O2S/c8-7(9,10)4-13-16(14,15)12-3-5-1-6(11)2-5/h5-6,12-13H,1-4,11H2.
What are the key properties of 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine?
3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine has a molecular weight of 261.27 g/mol, XLogP of -0.29, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclobutan-1-amine is sourced from PubChem (CID 114812875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).