4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide

C19H17FN2O2S — CID 3741145

IUPAC4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide
SMILESCC(c1ccccn1)N(c1ccccc1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C19H17FN2O2S/c1-15(19-9-5-6-14-21-19)22(17-7-3-2-4-8-17)25(23,24)18-12-10-16(20)11-13-18/h2-15H,1H3
InChIKeyNTFLOSPZEFIIBJ-UHFFFAOYSA-N
MW356.42 g/mol
LogP4.18
Rot. Bonds5

About 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide

4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide (PubChem CID 3741145) has the molecular formula C19H17FN2O2S and a molecular weight of 356.42 g/mol. Its IUPAC name is 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide
PubChem CID3741145
Molecular FormulaC19H17FN2O2S
Molecular Weight356.42 g/mol
Exact Mass356.10
IUPAC Name4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide
SMILESCC(c1ccccn1)N(c1ccccc1)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C19H17FN2O2S/c1-15(19-9-5-6-14-21-19)22(17-7-3-2-4-8-17)25(23,24)18-12-10-16(20)11-13-18/h2-15H,1H3
InChIKeyNTFLOSPZEFIIBJ-UHFFFAOYSA-N
XLogP4.18
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[phenyl(1-pyridin-2-ylethyl)sulfamoyl]phenyl]acetamide
CID 3712981
N,1-diphenyl-N-(1-pyridin-2-ylethyl)methanesulfonamide
CID 4209849
4-fluoro-N-[(1R)-1-(3-methylphenyl)ethyl]-N-phenylbenzenesulfonamide
CID 93207092
N-(4-fluorophenyl)-N-[1-(2-methoxyphenyl)ethyl]benzenesulfonamide
CID 42841669
4-chloro-N-(4-fluorophenyl)-N-[(1R)-1-(2-fluorophenyl)ethyl]benzenesulfonamide
CID 93207173
4-bromo-N-phenyl-N-propan-2-ylbenzenesulfonamide
CID 56541765
4-fluoro-N-[1-(4-fluorophenyl)ethyl]-N-(4-methoxyphenyl)benzenesulfonamide
CID 46022049
4-fluoro-N-[1-(2-fluorophenyl)ethyl]-N-(4-methoxyphenyl)benzenesulfonamide
CID 42841650
1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine
CID 15806675
N-(3-chlorophenyl)-4-fluoro-N-[(1R)-1-(2-methoxyphenyl)ethyl]benzenesulfonamide
CID 93207265
4-methyl-N-[(2R)-1-oxo-1-phenylpropan-2-yl]-N-phenylbenzenesulfonamide
CID 92534233
4-fluoro-N-[(1S)-1-(4-methoxyphenyl)ethyl]-N-(4-methylphenyl)benzenesulfonamide
CID 93207194

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide?
The IUPAC name of 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide (CID 3741145) is 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide.
What is the SMILES notation for 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide?
The canonical SMILES for 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide is CC(c1ccccn1)N(c1ccccc1)S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide?
The InChIKey is NTFLOSPZEFIIBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O2S/c1-15(19-9-5-6-14-21-19)22(17-7-3-2-4-8-17)25(23,24)18-12-10-16(20)11-13-18/h2-15H,1H3.
What are the key properties of 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide?
4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide has a molecular weight of 356.42 g/mol, XLogP of 4.18, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-phenyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide is sourced from PubChem (CID 3741145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).