2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide

C21H19FN2O3S — CID 23913704

IUPAC2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide
SMILESO=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1)Nc1ccccc1
InChIInChI=1S/C21H19FN2O3S/c22-18-11-13-20(14-12-18)28(26,27)24(15-17-7-3-1-4-8-17)16-21(25)23-19-9-5-2-6-10-19/h1-14H,15-16H2,(H,23,25)
InChIKeyRPFBKQGTOZJTER-UHFFFAOYSA-N
MW398.46 g/mol
LogP3.66
Rot. Bonds7

About 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide

2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide (PubChem CID 23913704) has the molecular formula C21H19FN2O3S and a molecular weight of 398.46 g/mol. Its IUPAC name is 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide.

Molecular Properties

Compound Name2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide
PubChem CID23913704
Molecular FormulaC21H19FN2O3S
Molecular Weight398.46 g/mol
Exact Mass398.11
IUPAC Name2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide
SMILESO=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1)Nc1ccccc1
InChIInChI=1S/C21H19FN2O3S/c22-18-11-13-20(14-12-18)28(26,27)24(15-17-7-3-1-4-8-17)16-21(25)23-19-9-5-2-6-10-19/h1-14H,15-16H2,(H,23,25)
InChIKeyRPFBKQGTOZJTER-UHFFFAOYSA-N
XLogP3.66
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.46
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[4-(diethylsulfamoyl)phenyl]sulfonyl-[(4-fluorophenyl)methyl]amino]-N-phenylacetamide
CID 1435666
2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-(2,6-dichlorophenyl)acetamide
CID 126010528
2-[benzyl-(4-bromophenyl)sulfonylamino]-N-(3-fluorophenyl)acetamide
CID 1329355
2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-[(4-fluorophenyl)methyl]acetamide
CID 4181243
2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-ethylacetamide
CID 30232535
2-[[4-(cyclohexylsulfamoyl)phenyl]sulfonyl-[(4-fluorophenyl)methyl]amino]-N-phenylacetamide
CID 3202155
2-[(4-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(4-phenoxyphenyl)acetamide
CID 126068032
2-[benzenesulfonyl(benzyl)amino]-N-(4-methylphenyl)acetamide
CID 2854852
2-[benzenesulfonyl-[(3,4-dichlorophenyl)methyl]amino]-N-(4-fluorophenyl)acetamide
CID 126010033
2-[benzyl-(3-chloro-4-methoxyphenyl)sulfonylamino]-N-(4-fluorophenyl)acetamide
CID 3292626
ethyl 1-[4-[[2-[benzyl-(4-fluorophenyl)sulfonylamino]acetyl]amino]phenyl]cyclopropane-1-carboxylate
CID 100790947
2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(4-fluorophenyl)acetamide
CID 987006

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide?
The IUPAC name of 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide (CID 23913704) is 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide.
What is the SMILES notation for 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide?
The canonical SMILES for 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide is O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1)Nc1ccccc1.
What is the InChIKey of 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide?
The InChIKey is RPFBKQGTOZJTER-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O3S/c22-18-11-13-20(14-12-18)28(26,27)24(15-17-7-3-1-4-8-17)16-21(25)23-19-9-5-2-6-10-19/h1-14H,15-16H2,(H,23,25).
What are the key properties of 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide?
2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide has a molecular weight of 398.46 g/mol, XLogP of 3.66, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl-(4-fluorophenyl)sulfonylamino]-N-phenylacetamide is sourced from PubChem (CID 23913704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).