N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide

C23H23NO3S — CID 9184966

IUPACN-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC[C@@H](c1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C23H23NO3S/c25-23(17-16-19-10-4-1-5-11-19)24-18-22(20-12-6-2-7-13-20)28(26,27)21-14-8-3-9-15-21/h1-15,22H,16-18H2,(H,24,25)/t22-/m0/s1
InChIKeyOUYBAZKUWJUPHO-QFIPXVFZSA-N
MW393.51 g/mol
LogP3.95
Rot. Bonds8

About N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide

N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide (PubChem CID 9184966) has the molecular formula C23H23NO3S and a molecular weight of 393.51 g/mol. Its IUPAC name is N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide
PubChem CID9184966
Molecular FormulaC23H23NO3S
Molecular Weight393.51 g/mol
Exact Mass393.14
IUPAC NameN-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC[C@@H](c1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C23H23NO3S/c25-23(17-16-19-10-4-1-5-11-19)24-18-22(20-12-6-2-7-13-20)28(26,27)21-14-8-3-9-15-21/h1-15,22H,16-18H2,(H,24,25)/t22-/m0/s1
InChIKeyOUYBAZKUWJUPHO-QFIPXVFZSA-N
XLogP3.95
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.51
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-2-hydroxy-2-phenylethyl]-3-phenylpropanamide
CID 93032888
N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-2-methylpropanamide
CID 9184545
N'-[(2S)-2-(benzenesulfonyl)-2-phenylethyl]-N-methyloxamide
CID 9185098
[3-(benzenesulfonyl)-3-phenylpropyl]benzene
CID 174743657
N-(2,2-diphenylethyl)-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 27770572
N-[(2S)-2-(benzenesulfonyl)-2-phenylethyl]-4-methylbenzamide
CID 9184686
N-(2-amino-2-phenylethyl)-3-[4-(methylsulfamoyl)phenyl]propanamide;hydrochloride
CID 119529188
N-[2-(4-fluorophenyl)sulfonyl-2-phenylethyl]-3-methylbutanamide
CID 110315057
3-(4-aminophenyl)-N-(2-hydroxy-2-phenylethyl)propanamide
CID 61036910
N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]cyclohexanecarboxamide
CID 9184612
3-[4-(cyclopropylsulfamoyl)phenyl]-N-(2,2-diphenylethyl)propanamide
CID 55570051
N-[(2S)-2-(benzenesulfonyl)-2-phenylethyl]-N'-[(2S)-butan-2-yl]oxamide
CID 9185186

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide?
The IUPAC name of N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide (CID 9184966) is N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide.
What is the SMILES notation for N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide?
The canonical SMILES for N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide is O=C(CCc1ccccc1)NC[C@@H](c1ccccc1)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide?
The InChIKey is OUYBAZKUWJUPHO-QFIPXVFZSA-N. The full InChI is InChI=1S/C23H23NO3S/c25-23(17-16-19-10-4-1-5-11-19)24-18-22(20-12-6-2-7-13-20)28(26,27)21-14-8-3-9-15-21/h1-15,22H,16-18H2,(H,24,25)/t22-/m0/s1.
What are the key properties of N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide?
N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide has a molecular weight of 393.51 g/mol, XLogP of 3.95, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(benzenesulfonyl)-2-phenylethyl]-3-phenylpropanamide is sourced from PubChem (CID 9184966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).