2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide

C16H16ClFN2O3S — CID 110601240

IUPAC2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide
SMILESCC(NS(=O)(=O)Cc1ccccc1Cl)C(=O)Nc1ccccc1F
InChIInChI=1S/C16H16ClFN2O3S/c1-11(16(21)19-15-9-5-4-8-14(15)18)20-24(22,23)10-12-6-2-3-7-13(12)17/h2-9,11,20H,10H2,1H3,(H,19,21)
InChIKeyCLXZVQPFEFCUEY-UHFFFAOYSA-N
MW370.83 g/mol
LogP2.93
Rot. Bonds6

About 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide

2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide (PubChem CID 110601240) has the molecular formula C16H16ClFN2O3S and a molecular weight of 370.83 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide
PubChem CID110601240
Molecular FormulaC16H16ClFN2O3S
Molecular Weight370.83 g/mol
Exact Mass370.06
IUPAC Name2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide
SMILESCC(NS(=O)(=O)Cc1ccccc1Cl)C(=O)Nc1ccccc1F
InChIInChI=1S/C16H16ClFN2O3S/c1-11(16(21)19-15-9-5-4-8-14(15)18)20-24(22,23)10-12-6-2-3-7-13(12)17/h2-9,11,20H,10H2,1H3,(H,19,21)
InChIKeyCLXZVQPFEFCUEY-UHFFFAOYSA-N
XLogP2.93
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.83
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-2-(methylsulfamoylamino)propanamide
CID 110606507
N-(2-fluorophenyl)-2-[2-(2-methoxyethoxy)ethylsulfonylamino]propanamide
CID 110606513
2-[(3,4-dichlorophenyl)sulfonylamino]-N-(2-fluorophenyl)propanamide
CID 110601229
N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide
CID 110601235
2-[(4-acetylphenyl)sulfonylamino]-N-(2-fluorophenyl)propanamide
CID 110408013
N-(2-fluorophenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide
CID 43890221
(2S)-2-(2-chlorophenyl)sulfanyl-N-(2-fluorophenyl)propanamide
CID 2498847
(2R)-2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-fluorophenyl)propanamide
CID 984226
[(2S)-1-(2-fluoroanilino)-1-oxopropan-2-yl] 2-(2-chloro-6-fluorophenyl)acetate
CID 7718260
2-[(4-chlorophenyl)carbamoylamino]-N-(2-fluorophenyl)propanamide
CID 110407940
(2S)-2-[(R)-(2-chloro-6-fluorophenyl)methylsulfinyl]-N-(2-fluorophenyl)propanamide
CID 95169378
2,4-dichloro-N-[1-(2-fluoroanilino)-1-oxopropan-2-yl]benzamide
CID 46756631

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide?
The IUPAC name of 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide (CID 110601240) is 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide?
The canonical SMILES for 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide is CC(NS(=O)(=O)Cc1ccccc1Cl)C(=O)Nc1ccccc1F.
What is the InChIKey of 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide?
The InChIKey is CLXZVQPFEFCUEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClFN2O3S/c1-11(16(21)19-15-9-5-4-8-14(15)18)20-24(22,23)10-12-6-2-3-7-13(12)17/h2-9,11,20H,10H2,1H3,(H,19,21).
What are the key properties of 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide?
2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide has a molecular weight of 370.83 g/mol, XLogP of 2.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methylsulfonylamino]-N-(2-fluorophenyl)propanamide is sourced from PubChem (CID 110601240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).