N-[2-(difluoromethoxy)phenyl]benzenesulfonamide

C13H11F2NO3S — CID 8504766

IUPACN-[2-(difluoromethoxy)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1OC(F)F)c1ccccc1
InChIInChI=1S/C13H11F2NO3S/c14-13(15)19-12-9-5-4-8-11(12)16-20(17,18)10-6-2-1-3-7-10/h1-9,13,16H
InChIKeyJSEZCCLPQCZOBF-UHFFFAOYSA-N
MW299.30 g/mol
LogP3.09
Rot. Bonds5

About N-[2-(difluoromethoxy)phenyl]benzenesulfonamide

N-[2-(difluoromethoxy)phenyl]benzenesulfonamide (PubChem CID 8504766) has the molecular formula C13H11F2NO3S and a molecular weight of 299.30 g/mol. Its IUPAC name is N-[2-(difluoromethoxy)phenyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[2-(difluoromethoxy)phenyl]benzenesulfonamide
PubChem CID8504766
Molecular FormulaC13H11F2NO3S
Molecular Weight299.30 g/mol
Exact Mass299.04
IUPAC NameN-[2-(difluoromethoxy)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccccc1OC(F)F)c1ccccc1
InChIInChI=1S/C13H11F2NO3S/c14-13(15)19-12-9-5-4-8-11(12)16-20(17,18)10-6-2-1-3-7-10/h1-9,13,16H
InChIKeyJSEZCCLPQCZOBF-UHFFFAOYSA-N
XLogP3.09
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.30
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(difluoromethoxy)phenyl]-4-fluorobenzenesulfonamide
CID 7950025
4-bromo-N-[2-(difluoromethoxy)phenyl]-3-methylbenzenesulfonamide
CID 8504785
N-[2-(difluoromethoxy)phenyl]-4-morpholin-4-ylsulfonylbenzenesulfonamide
CID 3904128
4-fluoro-N-(2-propan-2-yloxyphenyl)benzenesulfonamide
CID 53277912
5-(aminomethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-sulfonamide
CID 106030466
N-[2-(difluoromethoxy)phenyl]-3-(4-methylpiperazin-1-yl)benzenesulfonamide
CID 56654456
N-[2-(difluoromethoxy)phenyl]-3-piperazin-1-ylbenzenesulfonamide
CID 56654455
4-chloro-N-[2-(difluoromethoxy)phenyl]-3-nitrobenzenesulfonamide
CID 5212031
N-[2-(difluoromethoxy)phenyl]-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 2353818
N-[4-(difluoromethoxy)-3-fluorophenyl]benzenesulfonamide
CID 60534485
N-[2-(difluoromethoxy)phenyl]-2-fluoro-5-methylbenzenesulfonamide
CID 60532633
2-(benzenesulfonyl)-N-[2-(difluoromethoxy)phenyl]acetamide
CID 112779682

Frequently Asked Questions

What is the IUPAC name of N-[2-(difluoromethoxy)phenyl]benzenesulfonamide?
The IUPAC name of N-[2-(difluoromethoxy)phenyl]benzenesulfonamide (CID 8504766) is N-[2-(difluoromethoxy)phenyl]benzenesulfonamide.
What is the SMILES notation for N-[2-(difluoromethoxy)phenyl]benzenesulfonamide?
The canonical SMILES for N-[2-(difluoromethoxy)phenyl]benzenesulfonamide is O=S(=O)(Nc1ccccc1OC(F)F)c1ccccc1.
What is the InChIKey of N-[2-(difluoromethoxy)phenyl]benzenesulfonamide?
The InChIKey is JSEZCCLPQCZOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2NO3S/c14-13(15)19-12-9-5-4-8-11(12)16-20(17,18)10-6-2-1-3-7-10/h1-9,13,16H.
What are the key properties of N-[2-(difluoromethoxy)phenyl]benzenesulfonamide?
N-[2-(difluoromethoxy)phenyl]benzenesulfonamide has a molecular weight of 299.30 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(difluoromethoxy)phenyl]benzenesulfonamide is sourced from PubChem (CID 8504766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).