N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide

C23H23FN2O3S — CID 2954630

IUPACN-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide
SMILESCC(NS(=O)(=O)c1ccc(CCC(=O)Nc2cccc(F)c2)cc1)c1ccccc1
InChIInChI=1S/C23H23FN2O3S/c1-17(19-6-3-2-4-7-19)26-30(28,29)22-13-10-18(11-14-22)12-15-23(27)25-21-9-5-8-20(24)16-21/h2-11,13-14,16-17,26H,12,15H2,1H3,(H,25,27)
InChIKeyYSORUKHQMUSFIG-UHFFFAOYSA-N
MW426.51 g/mol
LogP4.44
Rot. Bonds8

About N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide

N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide (PubChem CID 2954630) has the molecular formula C23H23FN2O3S and a molecular weight of 426.51 g/mol. Its IUPAC name is N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide
PubChem CID2954630
Molecular FormulaC23H23FN2O3S
Molecular Weight426.51 g/mol
Exact Mass426.14
IUPAC NameN-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide
SMILESCC(NS(=O)(=O)c1ccc(CCC(=O)Nc2cccc(F)c2)cc1)c1ccccc1
InChIInChI=1S/C23H23FN2O3S/c1-17(19-6-3-2-4-7-19)26-30(28,29)22-13-10-18(11-14-22)12-15-23(27)25-21-9-5-8-20(24)16-21/h2-11,13-14,16-17,26H,12,15H2,1H3,(H,25,27)
InChIKeyYSORUKHQMUSFIG-UHFFFAOYSA-N
XLogP4.44
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.51
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-3-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 1007033
N-(3-chlorophenyl)-3-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 126237934
N-(3-nitrophenyl)-3-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 126244326
N-naphthalen-1-yl-3-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 126235471
N-[4-(cyanomethyl)phenyl]-3-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 100796380
N-(4-chloro-2-methylphenyl)-3-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 126255485
N-(2-bromophenyl)-3-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 126242030
N-(2,4-dimethylphenyl)-3-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 126242074
2-[2-chloro-4-(1-phenylethylsulfamoyl)phenoxy]-N-(3-fluorophenyl)acetamide
CID 3618567
N-[1-(3-bromophenyl)ethyl]-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide
CID 43873824
N-[(1R)-1-(3-bromophenyl)ethyl]-3-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 28556841
methyl 5-[3-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]propanoylamino]-1-benzothiophene-2-carboxylate
CID 28556868

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide?
The IUPAC name of N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide (CID 2954630) is N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide?
The canonical SMILES for N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide is CC(NS(=O)(=O)c1ccc(CCC(=O)Nc2cccc(F)c2)cc1)c1ccccc1.
What is the InChIKey of N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide?
The InChIKey is YSORUKHQMUSFIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN2O3S/c1-17(19-6-3-2-4-7-19)26-30(28,29)22-13-10-18(11-14-22)12-15-23(27)25-21-9-5-8-20(24)16-21/h2-11,13-14,16-17,26H,12,15H2,1H3,(H,25,27).
What are the key properties of N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide?
N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide has a molecular weight of 426.51 g/mol, XLogP of 4.44, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-3-[4-(1-phenylethylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 2954630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).