4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide

C22H21FN2O3S — CID 9164346

IUPAC4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide
SMILESC[C@@H](CNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)c1ccccc1
InChIInChI=1S/C22H21FN2O3S/c1-16(17-5-3-2-4-6-17)15-24-22(26)18-7-11-20(12-8-18)25-29(27,28)21-13-9-19(23)10-14-21/h2-14,16,25H,15H2,1H3,(H,24,26)/t16-/m0/s1
InChIKeyOJUWCPXOIKAZHU-INIZCTEOSA-N
MW412.49 g/mol
LogP4.16
Rot. Bonds7

About 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide

4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide (PubChem CID 9164346) has the molecular formula C22H21FN2O3S and a molecular weight of 412.49 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide.

Molecular Properties

Compound Name4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide
PubChem CID9164346
Molecular FormulaC22H21FN2O3S
Molecular Weight412.49 g/mol
Exact Mass412.13
IUPAC Name4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide
SMILESC[C@@H](CNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)c1ccccc1
InChIInChI=1S/C22H21FN2O3S/c1-16(17-5-3-2-4-6-17)15-24-22(26)18-7-11-20(12-8-18)25-29(27,28)21-13-9-19(23)10-14-21/h2-14,16,25H,15H2,1H3,(H,24,26)/t16-/m0/s1
InChIKeyOJUWCPXOIKAZHU-INIZCTEOSA-N
XLogP4.16
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.49
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164353
3-[(4-fluorophenyl)sulfamoyl]-N-[(2S)-2-phenylpropyl]benzamide
CID 9302470
4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 9315283
4-[(4-fluorophenyl)sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 9315282
4-(ethylsulfonylamino)-N-(2-phenylpropyl)benzamide
CID 133163901
N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-4-[(4-fluorophenyl)sulfamoyl]benzamide
CID 43018910
4-[(2-methylphenyl)sulfamoyl]-N-[(2S)-2-phenylpropyl]benzamide
CID 9164348
4-[(4-fluorophenyl)sulfamoyl]-N-(2-phenylsulfanylethyl)benzamide
CID 26444549
4-[(4-fluorophenyl)sulfamoyl]-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]benzamide
CID 55655448
4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide
CID 9301395
4-(benzenesulfonamido)-N-[(2R)-2-(ethylamino)propyl]benzamide
CID 120653123
4-[(4-fluorophenyl)sulfonylamino]-N-(2-phenoxyethyl)benzamide
CID 27758316

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide?
The IUPAC name of 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide (CID 9164346) is 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide.
What is the SMILES notation for 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide?
The canonical SMILES for 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide is C[C@@H](CNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)c1ccccc1.
What is the InChIKey of 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide?
The InChIKey is OJUWCPXOIKAZHU-INIZCTEOSA-N. The full InChI is InChI=1S/C22H21FN2O3S/c1-16(17-5-3-2-4-6-17)15-24-22(26)18-7-11-20(12-8-18)25-29(27,28)21-13-9-19(23)10-14-21/h2-14,16,25H,15H2,1H3,(H,24,26)/t16-/m0/s1.
What are the key properties of 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide?
4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide has a molecular weight of 412.49 g/mol, XLogP of 4.16, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide is sourced from PubChem (CID 9164346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).