2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide

C14H12ClFN2O3S — CID 51291589

IUPAC2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide
SMILESNC(=O)C(NS(=O)(=O)c1ccc(F)c(Cl)c1)c1ccccc1
InChIInChI=1S/C14H12ClFN2O3S/c15-11-8-10(6-7-12(11)16)22(20,21)18-13(14(17)19)9-4-2-1-3-5-9/h1-8,13,18H,(H2,17,19)
InChIKeyFGSVTAYSTDJDDF-UHFFFAOYSA-N
MW342.78 g/mol
LogP1.98
Rot. Bonds5

About 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide

2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide (PubChem CID 51291589) has the molecular formula C14H12ClFN2O3S and a molecular weight of 342.78 g/mol. Its IUPAC name is 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide.

Molecular Properties

Compound Name2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide
PubChem CID51291589
Molecular FormulaC14H12ClFN2O3S
Molecular Weight342.78 g/mol
Exact Mass342.02
IUPAC Name2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide
SMILESNC(=O)C(NS(=O)(=O)c1ccc(F)c(Cl)c1)c1ccccc1
InChIInChI=1S/C14H12ClFN2O3S/c15-11-8-10(6-7-12(11)16)22(20,21)18-13(14(17)19)9-4-2-1-3-5-9/h1-8,13,18H,(H2,17,19)
InChIKeyFGSVTAYSTDJDDF-UHFFFAOYSA-N
XLogP1.98
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.78
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-chlorophenyl)sulfonylamino]-2-phenylacetamide
CID 16604920
(2R)-2-[(3-chlorophenyl)sulfonylamino]-2-phenylacetamide
CID 51472168
(2S)-2-(naphthalen-2-ylsulfonylamino)-2-phenylacetamide
CID 51472155
2-[(3-chloro-4-methyl-5-nitrophenyl)sulfonylamino]-2-phenylacetamide
CID 55508645
(2R)-2-[(2,6-difluorophenyl)sulfonylamino]-2-phenylacetamide
CID 94579625
methyl 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-3-phenylpropanoate
CID 3673321
4-chloro-N-[(1S)-2-hydrazinyl-2-oxo-1-phenylethyl]benzenesulfonamide
CID 70638313
2-[(3-chloro-4-fluorophenyl)sulfonylamino]-3-hydroxypropanoic acid
CID 43091688
(2S,3R)-2-[(3-chloro-4-fluorophenyl)sulfonylamino]-3-hydroxybutanoic acid
CID 93302578
2-[(2,5-dichlorophenyl)sulfonylamino]-2-phenylacetic acid
CID 71563429
(2S)-2-[(3-fluoro-4-methoxyphenyl)sulfonylamino]-2-phenylacetic acid
CID 42184451
(2R)-2-[(3-chloro-4-fluorophenyl)sulfonylamino]-N-ethylpropanamide
CID 8802546

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide?
The IUPAC name of 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide (CID 51291589) is 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide.
What is the SMILES notation for 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide?
The canonical SMILES for 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide is NC(=O)C(NS(=O)(=O)c1ccc(F)c(Cl)c1)c1ccccc1.
What is the InChIKey of 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide?
The InChIKey is FGSVTAYSTDJDDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClFN2O3S/c15-11-8-10(6-7-12(11)16)22(20,21)18-13(14(17)19)9-4-2-1-3-5-9/h1-8,13,18H,(H2,17,19).
What are the key properties of 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide?
2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide has a molecular weight of 342.78 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chloro-4-fluorophenyl)sulfonylamino]-2-phenylacetamide is sourced from PubChem (CID 51291589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).