3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide

C17H20N2O4S — CID 793744

IUPAC3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2O)c1
InChIInChI=1S/C17H20N2O4S/c1-3-19(4-2)24(22,23)14-9-7-8-13(12-14)17(21)18-15-10-5-6-11-16(15)20/h5-12,20H,3-4H2,1-2H3,(H,18,21)
InChIKeyQUKOPGBBHROFBN-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.67
Rot. Bonds6

About 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide

3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide (PubChem CID 793744) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide
PubChem CID793744
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2O)c1
InChIInChI=1S/C17H20N2O4S/c1-3-19(4-2)24(22,23)14-9-7-8-13(12-14)17(21)18-15-10-5-6-11-16(15)20/h5-12,20H,3-4H2,1-2H3,(H,18,21)
InChIKeyQUKOPGBBHROFBN-UHFFFAOYSA-N
XLogP2.67
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

3-(diethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591095
N-[2-[(2R)-butan-2-yl]phenyl]-3-(diethylsulfamoyl)benzamide
CID 2670766
3-(diethylsulfamoyl)-N-[2-(difluoromethylsulfanyl)phenyl]benzamide
CID 8911034
3-(diethylsulfamoyl)-N-(2-thiophen-2-ylphenyl)benzamide
CID 55469920
3-(diethylsulfamoyl)-N-methylbenzamide
CID 47099917
3-(diethylsulfamoyl)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 4003550
4-(diethylsulfamoyl)-N-(2-hydroxyphenyl)thiophene-2-carboxamide
CID 6503203
2-[[3-(dipropylsulfamoyl)benzoyl]amino]benzoic acid
CID 45340807
3-(diethylsulfamoyl)-N-(4-ethylphenyl)benzamide
CID 2684396
3-(diethylsulfamoyl)-N-propylbenzamide
CID 2709423
3-(dipropylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591009
N-(5-bromo-2-methoxyphenyl)-3-(diethylsulfamoyl)benzamide
CID 52707757

Frequently Asked Questions

What is the IUPAC name of 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide?
The IUPAC name of 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide (CID 793744) is 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide.
What is the SMILES notation for 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide?
The canonical SMILES for 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide is CCN(CC)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2O)c1.
What is the InChIKey of 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide?
The InChIKey is QUKOPGBBHROFBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-3-19(4-2)24(22,23)14-9-7-8-13(12-14)17(21)18-15-10-5-6-11-16(15)20/h5-12,20H,3-4H2,1-2H3,(H,18,21).
What are the key properties of 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide?
3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylsulfamoyl)-N-(2-hydroxyphenyl)benzamide is sourced from PubChem (CID 793744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).