(2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide

C15H14ClFN2O3S — CID 9068716

IUPAC(2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
SMILESC[C@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C15H14ClFN2O3S/c1-10(15(20)18-13-6-2-11(16)3-7-13)19-23(21,22)14-8-4-12(17)5-9-14/h2-10,19H,1H3,(H,18,20)/t10-/m0/s1
InChIKeyRMUIKRABBSITDT-JTQLQIEISA-N
MW356.81 g/mol
LogP2.78
Rot. Bonds5

About (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide

(2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide (PubChem CID 9068716) has the molecular formula C15H14ClFN2O3S and a molecular weight of 356.81 g/mol. Its IUPAC name is (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide.

Molecular Properties

Compound Name(2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
PubChem CID9068716
Molecular FormulaC15H14ClFN2O3S
Molecular Weight356.81 g/mol
Exact Mass356.04
IUPAC Name(2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
SMILESC[C@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C15H14ClFN2O3S/c1-10(15(20)18-13-6-2-11(16)3-7-13)19-23(21,22)14-8-4-12(17)5-9-14/h2-10,19H,1H3,(H,18,20)/t10-/m0/s1
InChIKeyRMUIKRABBSITDT-JTQLQIEISA-N
XLogP2.78
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
CID 1263361
2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)propanamide
CID 4539824
(2S)-N-(4-acetamidophenyl)-2-[(4-chlorophenyl)sulfonylamino]propanamide
CID 2100165
N-(4-bromophenyl)-2-[(4-chlorophenyl)sulfonylamino]propanamide
CID 50740332
(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)propanamide
CID 124549106
2-[(4-chlorophenyl)sulfonylamino]-N-phenylpropanamide
CID 50740302
(2R)-2-[(4-chlorophenyl)sulfonylamino]-N-(2,5-difluorophenyl)propanamide
CID 28549159
(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(3-fluoro-4-methylphenyl)propanamide
CID 41260416
(2R)-N-(4-fluorophenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 124548460
(2S)-N-(2,4-dichlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
CID 7366747
(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-[(1R)-1-(4-fluorophenyl)ethyl]propanamide
CID 30403950
N-[(4-chlorophenyl)methyl]-2-[(4-fluorophenyl)sulfonylamino]propanamide
CID 3994624

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide?
The IUPAC name of (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide (CID 9068716) is (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide.
What is the SMILES notation for (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide?
The canonical SMILES for (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide is C[C@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide?
The InChIKey is RMUIKRABBSITDT-JTQLQIEISA-N. The full InChI is InChI=1S/C15H14ClFN2O3S/c1-10(15(20)18-13-6-2-11(16)3-7-13)19-23(21,22)14-8-4-12(17)5-9-14/h2-10,19H,1H3,(H,18,20)/t10-/m0/s1.
What are the key properties of (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide?
(2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide has a molecular weight of 356.81 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide is sourced from PubChem (CID 9068716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).