4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide

C20H26N2O4S — CID 121111975

IUPAC4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(C)(O)c2ccccc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-4-22(5-2)27(25,26)18-13-11-16(12-14-18)19(23)21-15-20(3,24)17-9-7-6-8-10-17/h6-14,24H,4-5,15H2,1-3H3,(H,21,23)
InChIKeyWOKRLIVXLBNPDW-UHFFFAOYSA-N
MW390.51 g/mol
LogP2.35
Rot. Bonds8

About 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide

4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide (PubChem CID 121111975) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide.

Molecular Properties

Compound Name4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide
PubChem CID121111975
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC Name4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(C)(O)c2ccccc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-4-22(5-2)27(25,26)18-13-11-16(12-14-18)19(23)21-15-20(3,24)17-9-7-6-8-10-17/h6-14,24H,4-5,15H2,1-3H3,(H,21,23)
InChIKeyWOKRLIVXLBNPDW-UHFFFAOYSA-N
XLogP2.35
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(diethylsulfamoyl)-N-(2-hydroxy-3-methoxy-2-methylpropyl)benzamide
CID 56724224
N-(2-hydroxy-2-phenylpropyl)-4-methylbenzamide
CID 110663962
4-(diethylsulfamoyl)-N-(2-phenylbutyl)benzamide
CID 43016057
N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 730591
4-(diethylsulfamoyl)-N-[(1-phenylcyclopropyl)methyl]benzamide
CID 41288116
4-chloro-3-(diethylsulfamoyl)-N-(2-methyl-2-phenylpropyl)benzamide
CID 39698452
N-[(2R)-2-cyclopropyl-2-hydroxy-2-phenylethyl]-4-(dimethylsulfamoyl)benzamide
CID 95379451
N-(2-cyclopropyl-2-hydroxy-2-thiophen-2-ylethyl)-4-(diethylsulfamoyl)benzamide
CID 90497084
N,N-diethyl-4-[[(4-methylbenzoyl)amino]carbamoyl]benzenesulfonamide
CID 2093173
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
4-(diethylsulfamoyl)-N-pyridin-2-ylbenzamide
CID 46671899
(2R)-2-[[4-(diethylsulfamoyl)benzoyl]amino]-2-phenylacetic acid
CID 119367792

Frequently Asked Questions

What is the IUPAC name of 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide?
The IUPAC name of 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide (CID 121111975) is 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide.
What is the SMILES notation for 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide?
The canonical SMILES for 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide is CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(C)(O)c2ccccc2)cc1.
What is the InChIKey of 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide?
The InChIKey is WOKRLIVXLBNPDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-4-22(5-2)27(25,26)18-13-11-16(12-14-18)19(23)21-15-20(3,24)17-9-7-6-8-10-17/h6-14,24H,4-5,15H2,1-3H3,(H,21,23).
What are the key properties of 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide?
4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide has a molecular weight of 390.51 g/mol, XLogP of 2.35, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylsulfamoyl)-N-(2-hydroxy-2-phenylpropyl)benzamide is sourced from PubChem (CID 121111975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).