1-fluoro-3-(sulfonylamino)benzene

C6H4FNO2S — CID 151719875

IUPAC1-fluoro-3-(sulfonylamino)benzene
SMILESO=S(=O)=Nc1cccc(F)c1
InChIInChI=1S/C6H4FNO2S/c7-5-2-1-3-6(4-5)8-11(9)10/h1-4H
InChIKeyRIIVIXCGASAJLZ-UHFFFAOYSA-N
MW173.17 g/mol
LogP1.52
Rot. Bonds1

About 1-fluoro-3-(sulfonylamino)benzene

1-fluoro-3-(sulfonylamino)benzene (PubChem CID 151719875) has the molecular formula C6H4FNO2S and a molecular weight of 173.17 g/mol. Its IUPAC name is 1-fluoro-3-(sulfonylamino)benzene.

Molecular Properties

Compound Name1-fluoro-3-(sulfonylamino)benzene
PubChem CID151719875
Molecular FormulaC6H4FNO2S
Molecular Weight173.17 g/mol
Exact Mass172.99
IUPAC Name1-fluoro-3-(sulfonylamino)benzene
SMILESO=S(=O)=Nc1cccc(F)c1
InChIInChI=1S/C6H4FNO2S/c7-5-2-1-3-6(4-5)8-11(9)10/h1-4H
InChIKeyRIIVIXCGASAJLZ-UHFFFAOYSA-N
XLogP1.52
TPSA46.50 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-fluoro-3-(sulfonylamino)benzene 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

ethyl-(3-fluorophenyl)imino-methyl-oxo-λ6-sulfane
CID 125450850
1-fluoro-3-nitrobenzene;sulfur trioxide
CID 167661335
1,1-difluoro-N-(3-fluorophenyl)propan-2-imine
CID 130247360
1,3-difluorobenzene;1,4-difluorobenzene
CID 159873588
1,1-bis(3-fluorophenyl)hydrazine
CID 68971186
(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)diazene
CID 166445658
N-(3-fluorophenyl)-1-(2,4,6-trifluorophenyl)methanimine
CID 23329282
1,3-difluorobenzene;methanol
CID 144994633
2-chloro-N'-(3-fluorophenyl)ethanimidamide
CID 169368865
CID 70927123
CID 70927123
N-(3-fluorophenyl)-1-(4-fluorophenyl)ethanimine
CID 139246224
1,3-difluorobenzene;formic acid
CID 158586074

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-(sulfonylamino)benzene?
The IUPAC name of 1-fluoro-3-(sulfonylamino)benzene (CID 151719875) is 1-fluoro-3-(sulfonylamino)benzene.
What is the SMILES notation for 1-fluoro-3-(sulfonylamino)benzene?
The canonical SMILES for 1-fluoro-3-(sulfonylamino)benzene is O=S(=O)=Nc1cccc(F)c1.
What is the InChIKey of 1-fluoro-3-(sulfonylamino)benzene?
The InChIKey is RIIVIXCGASAJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4FNO2S/c7-5-2-1-3-6(4-5)8-11(9)10/h1-4H.
What are the key properties of 1-fluoro-3-(sulfonylamino)benzene?
1-fluoro-3-(sulfonylamino)benzene has a molecular weight of 173.17 g/mol, XLogP of 1.52, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-(sulfonylamino)benzene is sourced from PubChem (CID 151719875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).