(2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide

C19H24N2O3S2 — CID 8883782

IUPAC(2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)[C@@H](C)Sc2ccccc2)c1
InChIInChI=1S/C19H24N2O3S2/c1-4-21(5-2)26(23,24)18-13-9-10-16(14-18)20-19(22)15(3)25-17-11-7-6-8-12-17/h6-15H,4-5H2,1-3H3,(H,20,22)/t15-/m1/s1
InChIKeyVBDZYWDJEFYPMK-OAHLLOKOSA-N
MW392.55 g/mol
LogP3.84
Rot. Bonds8

About (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide

(2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide (PubChem CID 8883782) has the molecular formula C19H24N2O3S2 and a molecular weight of 392.55 g/mol. Its IUPAC name is (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide.

Molecular Properties

Compound Name(2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide
PubChem CID8883782
Molecular FormulaC19H24N2O3S2
Molecular Weight392.55 g/mol
Exact Mass392.12
IUPAC Name(2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide
SMILESCCN(CC)S(=O)(=O)c1cccc(NC(=O)[C@@H](C)Sc2ccccc2)c1
InChIInChI=1S/C19H24N2O3S2/c1-4-21(5-2)26(23,24)18-13-9-10-16(14-18)20-19(22)15(3)25-17-11-7-6-8-12-17/h6-15H,4-5H2,1-3H3,(H,20,22)/t15-/m1/s1
InChIKeyVBDZYWDJEFYPMK-OAHLLOKOSA-N
XLogP3.84
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.55
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide
CID 7760061
N-[3-(diethylsulfamoyl)phenyl]-2-phenoxypropanamide
CID 18170408
(2R)-N-[3-(diethylsulfamoyl)phenyl]-2-methylpentanamide
CID 8883963
(2S)-N-[3-(dimethylsulfamoyl)phenyl]-2-(4-fluorophenyl)sulfanylpropanamide
CID 7553941
2-(4-bromophenyl)sulfanyl-N-(3-ethylsulfonylphenyl)propanamide
CID 86971404
2-bromo-N-[3-(diethylsulfamoyl)phenyl]butanamide
CID 62856650
N-phenyl-2-phenylsulfanylpropanamide
CID 2889315
N-[3-[methyl(methylsulfonyl)amino]phenyl]-2-phenylsulfanylpropanamide
CID 2942864
(2R)-N-[3-(dimethylsulfamoyl)phenyl]-2-(2-fluorophenyl)sulfanylpropanamide
CID 7964995
(2R)-2-(4-fluorophenyl)sulfanyl-N-(3-sulfamoylphenyl)propanamide
CID 40741893
N-[4-(diethylsulfamoyl)phenyl]-2-(3,4-dimethoxyphenyl)sulfanylpropanamide
CID 43875866
N-[3-(diethylsulfamoyl)phenyl]-2-methyl-2-phenylpropanamide
CID 16551934

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide?
The IUPAC name of (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide (CID 8883782) is (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide.
What is the SMILES notation for (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide?
The canonical SMILES for (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide is CCN(CC)S(=O)(=O)c1cccc(NC(=O)[C@@H](C)Sc2ccccc2)c1.
What is the InChIKey of (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide?
The InChIKey is VBDZYWDJEFYPMK-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N2O3S2/c1-4-21(5-2)26(23,24)18-13-9-10-16(14-18)20-19(22)15(3)25-17-11-7-6-8-12-17/h6-15H,4-5H2,1-3H3,(H,20,22)/t15-/m1/s1.
What are the key properties of (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide?
(2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide has a molecular weight of 392.55 g/mol, XLogP of 3.84, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[3-(diethylsulfamoyl)phenyl]-2-phenylsulfanylpropanamide is sourced from PubChem (CID 8883782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).