N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide

C21H19FN2O4S — CID 37311937

IUPACN-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide
SMILESCCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1
InChIInChI=1S/C21H19FN2O4S/c1-2-28-20-13-6-5-12-19(20)23-21(25)15-8-7-9-16(14-15)29(26,27)24-18-11-4-3-10-17(18)22/h3-14,24H,2H2,1H3,(H,23,25)
InChIKeyQGWFFHZTVRHIKC-UHFFFAOYSA-N
MW414.46 g/mol
LogP4.28
Rot. Bonds7

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

N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide (PubChem CID 37311937) has the molecular formula C21H19FN2O4S and a molecular weight of 414.46 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide
PubChem CID37311937
Molecular FormulaC21H19FN2O4S
Molecular Weight414.46 g/mol
Exact Mass414.10
IUPAC NameN-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide
SMILESCCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1
InChIInChI=1S/C21H19FN2O4S/c1-2-28-20-13-6-5-12-19(20)23-21(25)15-8-7-9-16(14-15)29(26,27)24-18-11-4-3-10-17(18)22/h3-14,24H,2H2,1H3,(H,23,25)
InChIKeyQGWFFHZTVRHIKC-UHFFFAOYSA-N
XLogP4.28
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.46
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethoxyphenyl)-3-(propylsulfamoyl)benzamide
CID 109061947
N-(4-fluoro-2-methylphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide
CID 7980566
3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591093
3-(diethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591095
N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26538254
3-[(2-fluorophenyl)sulfamoyl]-N-(2-methoxy-5-methylphenyl)benzamide
CID 2350153
N-ethyl-3-[[3-[(2-fluorophenyl)sulfamoyl]benzoyl]amino]benzamide
CID 55406945
3-[(2-ethoxyphenyl)sulfamoyl]-N-prop-2-enylbenzamide
CID 109062466
3-[(2-fluorophenyl)sulfamoyl]-N-(4-iodophenyl)benzamide
CID 42992510
3-(dipropylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591009
3-[(5-chloro-2-methoxyphenyl)sulfamoyl]-N-(2-fluorophenyl)benzamide
CID 26584389
3-[(2-fluorophenyl)sulfamoyl]-N-(3-methylphenyl)benzamide
CID 26537969

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide?
The IUPAC name of N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide (CID 37311937) is N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide is CCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1.
What is the InChIKey of N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide?
The InChIKey is QGWFFHZTVRHIKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O4S/c1-2-28-20-13-6-5-12-19(20)23-21(25)15-8-7-9-16(14-15)29(26,27)24-18-11-4-3-10-17(18)22/h3-14,24H,2H2,1H3,(H,23,25).
What are the key properties of N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide?
N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide has a molecular weight of 414.46 g/mol, XLogP of 4.28, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide is sourced from PubChem (CID 37311937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).