N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide

C13H13FN2O3S2 — CID 110601235

IUPACN-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide
SMILESCC(NS(=O)(=O)c1cccs1)C(=O)Nc1ccccc1F
InChIInChI=1S/C13H13FN2O3S2/c1-9(16-21(18,19)12-7-4-8-20-12)13(17)15-11-6-3-2-5-10(11)14/h2-9,16H,1H3,(H,15,17)
InChIKeyKTHXQZZAAWFKMB-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.19
Rot. Bonds5

About N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide

N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide (PubChem CID 110601235) has the molecular formula C13H13FN2O3S2 and a molecular weight of 328.39 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide
PubChem CID110601235
Molecular FormulaC13H13FN2O3S2
Molecular Weight328.39 g/mol
Exact Mass328.04
IUPAC NameN-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide
SMILESCC(NS(=O)(=O)c1cccs1)C(=O)Nc1ccccc1F
InChIInChI=1S/C13H13FN2O3S2/c1-9(16-21(18,19)12-7-4-8-20-12)13(17)15-11-6-3-2-5-10(11)14/h2-9,16H,1H3,(H,15,17)
InChIKeyKTHXQZZAAWFKMB-UHFFFAOYSA-N
XLogP2.19
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-fluorophenyl)-3-phenyl-2-(thiophen-2-ylsulfonylamino)propanamide
CID 15998707
N,2-dimethyl-3-[2-(thiophen-2-ylsulfonylamino)propanoylamino]benzamide
CID 48529738
N-(2-fluorophenyl)-2-(methylsulfamoylamino)propanamide
CID 110606507
N-(2-fluorophenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide
CID 43890221
2-[(4-acetylphenyl)sulfonylamino]-N-(2-fluorophenyl)propanamide
CID 110408013
N-propyl-2-(thiophen-2-ylsulfonylamino)propanamide
CID 46820888
N-(3-iodophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide
CID 55645413
(2R)-N-(1H-pyrazol-5-yl)-2-(thiophen-2-ylsulfonylamino)propanamide
CID 95280952
(2R)-2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-fluorophenyl)propanamide
CID 984226
2-[(3,4-dichlorophenyl)sulfonylamino]-N-(2-fluorophenyl)propanamide
CID 110601229
N-(1-methylpyrazol-3-yl)-2-(thiophen-2-ylsulfonylamino)propanamide
CID 47321746
2,2-dimethyl-N-[3-[2-(thiophen-2-ylsulfonylamino)propanoylamino]phenyl]propanamide
CID 55909819

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide?
The IUPAC name of N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide (CID 110601235) is N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide?
The canonical SMILES for N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide is CC(NS(=O)(=O)c1cccs1)C(=O)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide?
The InChIKey is KTHXQZZAAWFKMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O3S2/c1-9(16-21(18,19)12-7-4-8-20-12)13(17)15-11-6-3-2-5-10(11)14/h2-9,16H,1H3,(H,15,17).
What are the key properties of N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide?
N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide has a molecular weight of 328.39 g/mol, XLogP of 2.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-(thiophen-2-ylsulfonylamino)propanamide is sourced from PubChem (CID 110601235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).