1-(sulfamoylamino)-4-(trifluoromethyl)benzene

C7H7F3N2O2S — CID 10421755

IUPAC1-(sulfamoylamino)-4-(trifluoromethyl)benzene
SMILESNS(=O)(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C7H7F3N2O2S/c8-7(9,10)5-1-3-6(4-2-5)12-15(11,13)14/h1-4,12H,(H2,11,13,14)
InChIKeyLTJDGKNETMQCBO-UHFFFAOYSA-N
MW240.21 g/mol
LogP1.32
Rot. Bonds2

About 1-(sulfamoylamino)-4-(trifluoromethyl)benzene

1-(sulfamoylamino)-4-(trifluoromethyl)benzene (PubChem CID 10421755) has the molecular formula C7H7F3N2O2S and a molecular weight of 240.21 g/mol. Its IUPAC name is 1-(sulfamoylamino)-4-(trifluoromethyl)benzene.

Molecular Properties

Compound Name1-(sulfamoylamino)-4-(trifluoromethyl)benzene
PubChem CID10421755
Molecular FormulaC7H7F3N2O2S
Molecular Weight240.21 g/mol
Exact Mass240.02
IUPAC Name1-(sulfamoylamino)-4-(trifluoromethyl)benzene
SMILESNS(=O)(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C7H7F3N2O2S/c8-7(9,10)5-1-3-6(4-2-5)12-15(11,13)14/h1-4,12H,(H2,11,13,14)
InChIKeyLTJDGKNETMQCBO-UHFFFAOYSA-N
XLogP1.32
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.21
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-4-(sulfamoylamino)-1-[4-(trifluoromethyl)phenyl]benzene
CID 11428075
1-bromo-N-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 83093168
1,3-difluoro-2-(sulfamoylamino)-5-[4-(trifluoromethyl)phenyl]benzene
CID 11163979
1-arsanyl-4-(sulfamoylamino)benzene
CID 173270316
4-bromo-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 2212078
3,5-difluoro-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 26970283
benzene;(sulfamoylamino)benzene
CID 174742453
1-(4-sulfamoylphenyl)-3-[4-(trifluoromethyl)phenyl]urea
CID 2813478
4-propan-2-yl-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 3791590
(E)-2-phenyl-N-[4-(trifluoromethyl)phenyl]ethenesulfonamide
CID 26970285
4-(trifluoromethyl)-N'-[4-(trifluoromethyl)phenyl]benzenesulfonohydrazide
CID 20705865
ethane;4-(trifluoromethyl)-N-[4-(trifluoromethyl)phenyl]aniline
CID 144664157

Frequently Asked Questions

What is the IUPAC name of 1-(sulfamoylamino)-4-(trifluoromethyl)benzene?
The IUPAC name of 1-(sulfamoylamino)-4-(trifluoromethyl)benzene (CID 10421755) is 1-(sulfamoylamino)-4-(trifluoromethyl)benzene.
What is the SMILES notation for 1-(sulfamoylamino)-4-(trifluoromethyl)benzene?
The canonical SMILES for 1-(sulfamoylamino)-4-(trifluoromethyl)benzene is NS(=O)(=O)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 1-(sulfamoylamino)-4-(trifluoromethyl)benzene?
The InChIKey is LTJDGKNETMQCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2O2S/c8-7(9,10)5-1-3-6(4-2-5)12-15(11,13)14/h1-4,12H,(H2,11,13,14).
What are the key properties of 1-(sulfamoylamino)-4-(trifluoromethyl)benzene?
1-(sulfamoylamino)-4-(trifluoromethyl)benzene has a molecular weight of 240.21 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(sulfamoylamino)-4-(trifluoromethyl)benzene is sourced from PubChem (CID 10421755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).