4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide

C19H25N3O3S — CID 86911832

IUPAC4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide
SMILESCCN(CC)C(CNS(=O)(=O)c1ccc(C(N)=O)cc1)c1ccccc1
InChIInChI=1S/C19H25N3O3S/c1-3-22(4-2)18(15-8-6-5-7-9-15)14-21-26(24,25)17-12-10-16(11-13-17)19(20)23/h5-13,18,21H,3-4,14H2,1-2H3,(H2,20,23)
InChIKeyOTGQWYDISTUSPA-UHFFFAOYSA-N
MW375.49 g/mol
LogP2.15
Rot. Bonds9

About 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide

4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide (PubChem CID 86911832) has the molecular formula C19H25N3O3S and a molecular weight of 375.49 g/mol. Its IUPAC name is 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide
PubChem CID86911832
Molecular FormulaC19H25N3O3S
Molecular Weight375.49 g/mol
Exact Mass375.16
IUPAC Name4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide
SMILESCCN(CC)C(CNS(=O)(=O)c1ccc(C(N)=O)cc1)c1ccccc1
InChIInChI=1S/C19H25N3O3S/c1-3-22(4-2)18(15-8-6-5-7-9-15)14-21-26(24,25)17-12-10-16(11-13-17)19(20)23/h5-13,18,21H,3-4,14H2,1-2H3,(H2,20,23)
InChIKeyOTGQWYDISTUSPA-UHFFFAOYSA-N
XLogP2.15
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.49
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-N-[(2R)-2-(diethylamino)-2-phenylethyl]benzenesulfonamide
CID 2198403
4-chloro-N-[(2S)-2-(diethylamino)-2-phenylethyl]benzenesulfonamide
CID 2198405
4-acetyl-N-[2-(dimethylamino)-2-phenylethyl]benzenesulfonamide
CID 4883799
4-[2-(methylamino)propylsulfamoyl]benzamide
CID 120824934
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-4-methylbenzenesulfonamide
CID 975376
4-[[2-(dimethylamino)-2-phenylethyl]sulfamoyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 78786572
N-[2-(diethylamino)-2-phenylethyl]-2-hydroxyethanesulfonamide
CID 79588864
4-[(2-hydroxy-4-methylpentyl)sulfamoyl]benzamide
CID 103834407
4-[[(2S)-2-(diethylamino)propyl]sulfamoyl]-N,N-diethylbenzamide
CID 95341841
4-[(N-[2-[(4-methylphenyl)sulfonylamino]-1-phenylethyl]anilino)methyl]benzoic acid
CID 10195931
N-[(2S)-2-(diethylamino)-2-(4-methoxyphenyl)ethyl]-4-methylbenzenesulfonamide
CID 166440574
ethyl 4-[[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]sulfamoyl]benzoate
CID 51969738

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide?
The IUPAC name of 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide (CID 86911832) is 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide.
What is the SMILES notation for 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide?
The canonical SMILES for 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide is CCN(CC)C(CNS(=O)(=O)c1ccc(C(N)=O)cc1)c1ccccc1.
What is the InChIKey of 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide?
The InChIKey is OTGQWYDISTUSPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3S/c1-3-22(4-2)18(15-8-6-5-7-9-15)14-21-26(24,25)17-12-10-16(11-13-17)19(20)23/h5-13,18,21H,3-4,14H2,1-2H3,(H2,20,23).
What are the key properties of 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide?
4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide has a molecular weight of 375.49 g/mol, XLogP of 2.15, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(diethylamino)-2-phenylethyl]sulfamoyl]benzamide is sourced from PubChem (CID 86911832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).