N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide

C18H22N2O4S — CID 78796489

IUPACN-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
SMILESCCN(CCO)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C18H22N2O4S/c1-3-20(12-13-21)18(22)15-8-10-16(11-9-15)25(23,24)19-17-7-5-4-6-14(17)2/h4-11,19,21H,3,12-13H2,1-2H3
InChIKeyOTXFHEKHGQRWSX-UHFFFAOYSA-N
MW362.45 g/mol
LogP2.25
Rot. Bonds7

About N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide

N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide (PubChem CID 78796489) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
PubChem CID78796489
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC NameN-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
SMILESCCN(CCO)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C18H22N2O4S/c1-3-20(12-13-21)18(22)15-8-10-16(11-9-15)25(23,24)19-17-7-5-4-6-14(17)2/h4-11,19,21H,3,12-13H2,1-2H3
InChIKeyOTXFHEKHGQRWSX-UHFFFAOYSA-N
XLogP2.25
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-N-(2-hydroxyethyl)-4-(phenylsulfamoyl)benzamide
CID 78796066
N,N-diethyl-4-[[4-[(2-methylphenyl)sulfamoyl]benzoyl]amino]benzamide
CID 34542806
4-[(3,4-dimethylphenyl)sulfamoyl]-N-ethyl-N-(2-hydroxyethyl)benzamide
CID 78796492
N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 109065077
N-ethyl-N-(2-ethylbutyl)-4-[(2-fluorophenyl)sulfamoyl]benzamide
CID 39482944
N-(2-cyanoethyl)-N-(cyclobutylmethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 71856009
N-(2-methylphenyl)-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 9342166
N-ethyl-N-(2-phenylethyl)-4-(phenylsulfamoyl)benzamide
CID 55587739
N-[4-(diethylamino)phenyl]-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 27229309
N-methyl-4-[(2-methylphenyl)sulfamoyl]-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 9305406
N-[(4-chlorophenyl)methyl]-N-methyl-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 27773866
N-[(2,4-dimethylphenyl)methyl]-N-methyl-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 9227970

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide?
The IUPAC name of N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide (CID 78796489) is N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide is CCN(CCO)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2C)cc1.
What is the InChIKey of N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide?
The InChIKey is OTXFHEKHGQRWSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-3-20(12-13-21)18(22)15-8-10-16(11-9-15)25(23,24)19-17-7-5-4-6-14(17)2/h4-11,19,21H,3,12-13H2,1-2H3.
What are the key properties of N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide?
N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide has a molecular weight of 362.45 g/mol, XLogP of 2.25, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-hydroxyethyl)-4-[(2-methylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 78796489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).