N-(4-anilinophenyl)-4-fluorobenzenesulfonamide

C18H15FN2O2S — CID 897399

IUPACN-(4-anilinophenyl)-4-fluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Nc2ccccc2)cc1)c1ccc(F)cc1
InChIInChI=1S/C18H15FN2O2S/c19-14-6-12-18(13-7-14)24(22,23)21-17-10-8-16(9-11-17)20-15-4-2-1-3-5-15/h1-13,20-21H
InChIKeyDEOZPQNIHLXHJM-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.37
Rot. Bonds5

About N-(4-anilinophenyl)-4-fluorobenzenesulfonamide

N-(4-anilinophenyl)-4-fluorobenzenesulfonamide (PubChem CID 897399) has the molecular formula C18H15FN2O2S and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(4-anilinophenyl)-4-fluorobenzenesulfonamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)-4-fluorobenzenesulfonamide
PubChem CID897399
Molecular FormulaC18H15FN2O2S
Molecular Weight342.40 g/mol
Exact Mass342.08
IUPAC NameN-(4-anilinophenyl)-4-fluorobenzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Nc2ccccc2)cc1)c1ccc(F)cc1
InChIInChI=1S/C18H15FN2O2S/c19-14-6-12-18(13-7-14)24(22,23)21-17-10-8-16(9-11-17)20-15-4-2-1-3-5-15/h1-13,20-21H
InChIKeyDEOZPQNIHLXHJM-UHFFFAOYSA-N
XLogP4.37
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)-4-fluorobenzenesulfonamide?
The IUPAC name of N-(4-anilinophenyl)-4-fluorobenzenesulfonamide (CID 897399) is N-(4-anilinophenyl)-4-fluorobenzenesulfonamide.
What is the SMILES notation for N-(4-anilinophenyl)-4-fluorobenzenesulfonamide?
The canonical SMILES for N-(4-anilinophenyl)-4-fluorobenzenesulfonamide is O=S(=O)(Nc1ccc(Nc2ccccc2)cc1)c1ccc(F)cc1.
What is the InChIKey of N-(4-anilinophenyl)-4-fluorobenzenesulfonamide?
The InChIKey is DEOZPQNIHLXHJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O2S/c19-14-6-12-18(13-7-14)24(22,23)21-17-10-8-16(9-11-17)20-15-4-2-1-3-5-15/h1-13,20-21H.
What are the key properties of N-(4-anilinophenyl)-4-fluorobenzenesulfonamide?
N-(4-anilinophenyl)-4-fluorobenzenesulfonamide has a molecular weight of 342.40 g/mol, XLogP of 4.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)-4-fluorobenzenesulfonamide is sourced from PubChem (CID 897399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).