2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide

C10H13FN2O3S — CID 2964497

IUPAC2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide
SMILESCNC(=O)C(C)NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C10H13FN2O3S/c1-7(10(14)12-2)13-17(15,16)9-5-3-8(11)4-6-9/h3-7,13H,1-2H3,(H,12,14)
InChIKeyOASVRQHVOOSNAH-UHFFFAOYSA-N
MW260.29 g/mol
LogP0.24
Rot. Bonds4

About 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide

2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide (PubChem CID 2964497) has the molecular formula C10H13FN2O3S and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide.

Molecular Properties

Compound Name2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide
PubChem CID2964497
Molecular FormulaC10H13FN2O3S
Molecular Weight260.29 g/mol
Exact Mass260.06
IUPAC Name2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide
SMILESCNC(=O)C(C)NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C10H13FN2O3S/c1-7(10(14)12-2)13-17(15,16)9-5-3-8(11)4-6-9/h3-7,13H,1-2H3,(H,12,14)
InChIKeyOASVRQHVOOSNAH-UHFFFAOYSA-N
XLogP0.24
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 2957593
4-fluoro-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]benzenesulfonamide
CID 900413
N-cyclopropyl-N~2~-[(4-fluorophenyl)sulfonyl]-N~2~-methylglycinamide
CID 975127
(2S)-N-cyclohexyl-2-[(2-fluorophenyl)sulfonylamino]-3-methylbutanamide
CID 2129437
N-cyclopentyl-2-[ethyl-(4-fluorophenyl)sulfonylamino]acetamide
CID 2985558
1-(4-Fluorobenzenesulfonyl)-N-(3-methylbutyl)piperidine-2-carboxamide
CID 6619133
(2S)-2-[(4-fluorophenyl)sulfonylamino]-3-methyl-N-[(2S)-1-oxopropan-2-yl]butanamide
CID 11782479
N-(2-oxoazepan-3-yl)benzenesulfonamide
CID 2813201
4-((4-Fluorophenyl)sulfonyl)piperazin-2-one
CID 4320295
4-(Phenylsulfonyl)piperazin-2-one
CID 9397001
N-{2-[(phenylsulfonyl)amino]ethyl}acetamide
CID 235761
N-[1-(2-Fluoro-benzenesulfonyl)-piperidin-4-yl]-2,2-dimethyl-propionamide
CID 652036

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide?
The IUPAC name of 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide (CID 2964497) is 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide.
What is the SMILES notation for 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide?
The canonical SMILES for 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide is CNC(=O)C(C)NS(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide?
The InChIKey is OASVRQHVOOSNAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O3S/c1-7(10(14)12-2)13-17(15,16)9-5-3-8(11)4-6-9/h3-7,13H,1-2H3,(H,12,14).
What are the key properties of 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide?
2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide has a molecular weight of 260.29 g/mol, XLogP of 0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)sulfonylamino]-N-methylpropanamide is sourced from PubChem (CID 2964497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).