4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide

C19H24FN3O3S — CID 109060145

IUPAC4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide
SMILESCN(C)CCNS(=O)(=O)c1ccc(C(=O)NCCc2ccccc2F)cc1
InChIInChI=1S/C19H24FN3O3S/c1-23(2)14-13-22-27(25,26)17-9-7-16(8-10-17)19(24)21-12-11-15-5-3-4-6-18(15)20/h3-10,22H,11-14H2,1-2H3,(H,21,24)
InChIKeyDAWVYCRSOYHMQI-UHFFFAOYSA-N
MW393.48 g/mol
LogP1.64
Rot. Bonds9

About 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide

4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide (PubChem CID 109060145) has the molecular formula C19H24FN3O3S and a molecular weight of 393.48 g/mol. Its IUPAC name is 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide
PubChem CID109060145
Molecular FormulaC19H24FN3O3S
Molecular Weight393.48 g/mol
Exact Mass393.15
IUPAC Name4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide
SMILESCN(C)CCNS(=O)(=O)c1ccc(C(=O)NCCc2ccccc2F)cc1
InChIInChI=1S/C19H24FN3O3S/c1-23(2)14-13-22-27(25,26)17-9-7-16(8-10-17)19(24)21-12-11-15-5-3-4-6-18(15)20/h3-10,22H,11-14H2,1-2H3,(H,21,24)
InChIKeyDAWVYCRSOYHMQI-UHFFFAOYSA-N
XLogP1.64
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.48
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide?
The IUPAC name of 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide (CID 109060145) is 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide.
What is the SMILES notation for 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide?
The canonical SMILES for 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide is CN(C)CCNS(=O)(=O)c1ccc(C(=O)NCCc2ccccc2F)cc1.
What is the InChIKey of 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide?
The InChIKey is DAWVYCRSOYHMQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN3O3S/c1-23(2)14-13-22-27(25,26)17-9-7-16(8-10-17)19(24)21-12-11-15-5-3-4-6-18(15)20/h3-10,22H,11-14H2,1-2H3,(H,21,24).
What are the key properties of 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide?
4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide has a molecular weight of 393.48 g/mol, XLogP of 1.64, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(dimethylamino)ethylsulfamoyl]-N-[2-(2-fluorophenyl)ethyl]benzamide is sourced from PubChem (CID 109060145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).