3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide

C23H23FN2O3S — CID 132667869

IUPAC3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide
SMILESCCC(NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1)c1ccc(C)cc1
InChIInChI=1S/C23H23FN2O3S/c1-3-21(17-13-11-16(2)12-14-17)25-23(27)18-7-6-8-19(15-18)30(28,29)26-22-10-5-4-9-20(22)24/h4-15,21,26H,3H2,1-2H3,(H,25,27)
InChIKeyHHQAOUIQCOIUGD-UHFFFAOYSA-N
MW426.51 g/mol
LogP4.82
Rot. Bonds7

About 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide

3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide (PubChem CID 132667869) has the molecular formula C23H23FN2O3S and a molecular weight of 426.51 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide.

Molecular Properties

Compound Name3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide
PubChem CID132667869
Molecular FormulaC23H23FN2O3S
Molecular Weight426.51 g/mol
Exact Mass426.14
IUPAC Name3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide
SMILESCCC(NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1)c1ccc(C)cc1
InChIInChI=1S/C23H23FN2O3S/c1-3-21(17-13-11-16(2)12-14-17)25-23(27)18-7-6-8-19(15-18)30(28,29)26-22-10-5-4-9-20(22)24/h4-15,21,26H,3H2,1-2H3,(H,25,27)
InChIKeyHHQAOUIQCOIUGD-UHFFFAOYSA-N
XLogP4.82
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.51
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-fluorophenyl)sulfamoyl]-N-[(2R)-3-methylbutan-2-yl]benzamide
CID 40790769
3-[(2-fluorophenyl)sulfamoyl]-N-[(2S)-3-methylbutan-2-yl]benzamide
CID 40790771
3-[(2-fluorophenyl)sulfamoyl]-N-(1-hydroxypropan-2-yl)benzamide
CID 78856698
4-methyl-N-[(1R)-1-(4-methylphenyl)propyl]-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 30400896
4-methyl-N-[1-(4-methylphenyl)propyl]-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 43906098
3-(azepan-1-ylsulfonyl)-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
CID 99131768
3-[(4-fluorophenyl)-methylsulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide
CID 132672050
3-chloro-N-[(1R)-1-(4-methylphenyl)propyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 93486433
3-[(2-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)benzamide
CID 26537969
N-(1-aminohexan-2-yl)-3-[(2-fluorophenyl)sulfamoyl]benzamide;hydrochloride
CID 119666444
3-[(4-fluorophenyl)sulfamoyl]-N-[(1S)-1-(4-methoxyphenyl)propyl]benzamide
CID 27853826
N-[2-(ethylamino)-2-oxoethyl]-3-[(2-fluorophenyl)sulfamoyl]benzamide
CID 18145874

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide?
The IUPAC name of 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide (CID 132667869) is 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide.
What is the SMILES notation for 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide?
The canonical SMILES for 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide is CCC(NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1)c1ccc(C)cc1.
What is the InChIKey of 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide?
The InChIKey is HHQAOUIQCOIUGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN2O3S/c1-3-21(17-13-11-16(2)12-14-17)25-23(27)18-7-6-8-19(15-18)30(28,29)26-22-10-5-4-9-20(22)24/h4-15,21,26H,3H2,1-2H3,(H,25,27).
What are the key properties of 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide?
3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide has a molecular weight of 426.51 g/mol, XLogP of 4.82, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)sulfamoyl]-N-[1-(4-methylphenyl)propyl]benzamide is sourced from PubChem (CID 132667869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).