3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide

C23H23FN2O3S — CID 31281999

IUPAC3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NCCc2ccccc2F)c1
InChIInChI=1S/C23H23FN2O3S/c1-2-26(20-11-4-3-5-12-20)30(28,29)21-13-8-10-19(17-21)23(27)25-16-15-18-9-6-7-14-22(18)24/h3-14,17H,2,15-16H2,1H3,(H,25,27)
InChIKeyISABHRQYWLNONE-UHFFFAOYSA-N
MW426.51 g/mol
LogP4.01
Rot. Bonds8

About 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide

3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide (PubChem CID 31281999) has the molecular formula C23H23FN2O3S and a molecular weight of 426.51 g/mol. Its IUPAC name is 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide.

Molecular Properties

Compound Name3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide
PubChem CID31281999
Molecular FormulaC23H23FN2O3S
Molecular Weight426.51 g/mol
Exact Mass426.14
IUPAC Name3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NCCc2ccccc2F)c1
InChIInChI=1S/C23H23FN2O3S/c1-2-26(20-11-4-3-5-12-20)30(28,29)21-13-8-10-19(17-21)23(27)25-16-15-18-9-6-7-14-22(18)24/h3-14,17H,2,15-16H2,1H3,(H,25,27)
InChIKeyISABHRQYWLNONE-UHFFFAOYSA-N
XLogP4.01
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.51
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)-3-[ethyl(phenyl)sulfamoyl]benzamide
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3-[ethyl(phenyl)sulfamoyl]-N-(2-phenoxyethyl)benzamide
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3-[ethyl(phenyl)sulfamoyl]-N-[3-(2-phenylethoxy)propyl]benzamide
CID 55889436
N-(3,4-difluorophenyl)-3-[ethyl(phenyl)sulfamoyl]benzamide
CID 9165805
3-N,3-N-diethyl-1-N-[2-(2-fluorophenyl)ethyl]benzene-1,3-dicarboxamide
CID 109055375
3-[ethyl(phenyl)sulfamoyl]-N-(3-phenylprop-2-ynyl)benzamide
CID 55510278
N-(2-aminoethyl)-3-[butyl(phenyl)sulfamoyl]benzamide;hydrochloride
CID 119383856
3-[butyl(phenyl)sulfamoyl]-N-[2-(methylamino)ethyl]benzamide
CID 119502227
N-ethyl-3-[[(4-methylbenzoyl)amino]carbamoyl]-N-phenylbenzenesulfonamide
CID 2421051
3-[ethyl(phenyl)sulfamoyl]-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 37486403
4-[ethyl(phenyl)sulfamoyl]-N-(2-phenylethyl)benzamide
CID 4797803

Frequently Asked Questions

What is the IUPAC name of 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide?
The IUPAC name of 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide (CID 31281999) is 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide.
What is the SMILES notation for 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide?
The canonical SMILES for 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide is CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NCCc2ccccc2F)c1.
What is the InChIKey of 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide?
The InChIKey is ISABHRQYWLNONE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN2O3S/c1-2-26(20-11-4-3-5-12-20)30(28,29)21-13-8-10-19(17-21)23(27)25-16-15-18-9-6-7-14-22(18)24/h3-14,17H,2,15-16H2,1H3,(H,25,27).
What are the key properties of 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide?
3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide has a molecular weight of 426.51 g/mol, XLogP of 4.01, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl(phenyl)sulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide is sourced from PubChem (CID 31281999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).