3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide

C23H24N2O3S — CID 4793818

IUPAC3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
SMILESCC(NC(=O)CC(c1ccccc1)c1ccccc1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C23H24N2O3S/c1-17(18-12-14-21(15-13-18)29(24,27)28)25-23(26)16-22(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15,17,22H,16H2,1H3,(H,25,26)(H2,24,27,28)
InChIKeyPDNSOKUHHADBDK-UHFFFAOYSA-N
MW408.52 g/mol
LogP3.73
Rot. Bonds7

About 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide

3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide (PubChem CID 4793818) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
PubChem CID4793818
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC Name3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
SMILESCC(NC(=O)CC(c1ccccc1)c1ccccc1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C23H24N2O3S/c1-17(18-12-14-21(15-13-18)29(24,27)28)25-23(26)16-22(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15,17,22H,16H2,1H3,(H,25,26)(H2,24,27,28)
InChIKeyPDNSOKUHHADBDK-UHFFFAOYSA-N
XLogP3.73
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 43702371
2-phenylsulfanyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]acetamide
CID 2572446
4-oxo-4-phenyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]butanamide
CID 41023431
N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide
CID 17326867
3-(benzenesulfonamido)-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 43005594
2-(2-chlorophenyl)-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]acetamide
CID 27758673
N-[(1R)-1-(4-methoxyphenyl)ethyl]-3,3-diphenylpropanamide
CID 28572588
2-[2-oxo-2-[1-(4-sulfamoylphenyl)ethylamino]ethoxy]acetic acid
CID 60708265
3,3-diphenyl-N-[1-[4-(propanoylamino)phenyl]ethyl]propanamide
CID 46468381
2-[methyl(2-phenoxyethyl)amino]-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]acetamide
CID 8754897
2-[(2S)-2-phenylpyrrolidin-1-yl]-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]acetamide
CID 124739814
1-phenyl-3-[4-[(1R)-1-[(4-sulfamoylphenyl)carbamoylamino]ethyl]phenyl]urea
CID 52504623

Frequently Asked Questions

What is the IUPAC name of 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide?
The IUPAC name of 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide (CID 4793818) is 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide.
What is the SMILES notation for 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide?
The canonical SMILES for 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide is CC(NC(=O)CC(c1ccccc1)c1ccccc1)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide?
The InChIKey is PDNSOKUHHADBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-17(18-12-14-21(15-13-18)29(24,27)28)25-23(26)16-22(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-15,17,22H,16H2,1H3,(H,25,26)(H2,24,27,28).
What are the key properties of 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide?
3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide has a molecular weight of 408.52 g/mol, XLogP of 3.73, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide is sourced from PubChem (CID 4793818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).