3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide

C17H21NO2S — CID 110755445

IUPAC3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide
SMILESCC(NS(=O)(=O)CCCc1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO2S/c1-15(17-12-6-3-7-13-17)18-21(19,20)14-8-11-16-9-4-2-5-10-16/h2-7,9-10,12-13,15,18H,8,11,14H2,1H3
InChIKeyJGYOWVGCWXHWST-UHFFFAOYSA-N
MW303.43 g/mol
LogP3.30
Rot. Bonds7

About 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide

3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide (PubChem CID 110755445) has the molecular formula C17H21NO2S and a molecular weight of 303.43 g/mol. Its IUPAC name is 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide.

Molecular Properties

Compound Name3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide
PubChem CID110755445
Molecular FormulaC17H21NO2S
Molecular Weight303.43 g/mol
Exact Mass303.13
IUPAC Name3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide
SMILESCC(NS(=O)(=O)CCCc1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO2S/c1-15(17-12-6-3-7-13-17)18-21(19,20)14-8-11-16-9-4-2-5-10-16/h2-7,9-10,12-13,15,18H,8,11,14H2,1H3
InChIKeyJGYOWVGCWXHWST-UHFFFAOYSA-N
XLogP3.30
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.43
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide 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

2-methoxy-N-(1-phenylethyl)ethanesulfonamide
CID 71683981
N-[(1S)-1-(4-propylphenyl)ethyl]butane-1-sulfonamide
CID 26001989
N,N-dimethyl-4-[2-(1-phenylethylsulfamoyl)ethyl]benzenesulfonamide
CID 110299331
N-(1,4-diphenylbutyl)propane-1-sulfonamide
CID 60580802
1-phenyl-N-[(1R)-1-(4-phenylphenyl)ethyl]methanesulfonamide
CID 26529706
1-phenyl-N-[1-(4-phenylphenyl)ethyl]methanesulfonamide
CID 25036786
3-cyano-N-[1-(4-ethylphenyl)ethyl]propane-1-sulfonamide
CID 56787518
1-(3-methylphenyl)-N-[(1S)-1-phenylethyl]methanesulfonamide
CID 27210154
N-[(1R)-1-phenylethyl]prop-2-ene-1-sulfonamide
CID 142953388
3-(3-phenylpropylsulfonyl)butan-2-ol
CID 122142904
N-[(1S)-1-(4-bromophenyl)ethyl]-1-phenylmethanesulfonamide
CID 33037887
N-(1-chloropropan-2-yl)-2-phenylethanesulfonamide
CID 80688482

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide?
The IUPAC name of 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide (CID 110755445) is 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide.
What is the SMILES notation for 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide?
The canonical SMILES for 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide is CC(NS(=O)(=O)CCCc1ccccc1)c1ccccc1.
What is the InChIKey of 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide?
The InChIKey is JGYOWVGCWXHWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2S/c1-15(17-12-6-3-7-13-17)18-21(19,20)14-8-11-16-9-4-2-5-10-16/h2-7,9-10,12-13,15,18H,8,11,14H2,1H3.
What are the key properties of 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide?
3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide has a molecular weight of 303.43 g/mol, XLogP of 3.30, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-(1-phenylethyl)propane-1-sulfonamide is sourced from PubChem (CID 110755445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).