N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide

C11H15FN2O3S — CID 113059351

IUPACN-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
SMILESCC(=O)N(CCNS(C)(=O)=O)c1ccc(F)cc1
InChIInChI=1S/C11H15FN2O3S/c1-9(15)14(8-7-13-18(2,16)17)11-5-3-10(12)4-6-11/h3-6,13H,7-8H2,1-2H3
InChIKeyDCTWKKSTSFGDMO-UHFFFAOYSA-N
MW274.32 g/mol
LogP0.73
Rot. Bonds5

About N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide

N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide (PubChem CID 113059351) has the molecular formula C11H15FN2O3S and a molecular weight of 274.32 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
PubChem CID113059351
Molecular FormulaC11H15FN2O3S
Molecular Weight274.32 g/mol
Exact Mass274.08
IUPAC NameN-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
SMILESCC(=O)N(CCNS(C)(=O)=O)c1ccc(F)cc1
InChIInChI=1S/C11H15FN2O3S/c1-9(15)14(8-7-13-18(2,16)17)11-5-3-10(12)4-6-11/h3-6,13H,7-8H2,1-2H3
InChIKeyDCTWKKSTSFGDMO-UHFFFAOYSA-N
XLogP0.73
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetylphenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 113061694
N-[2-(methanesulfonamido)ethyl]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 113061531
N-[2-(N-acetyl-4-fluoroanilino)ethyl]acetamide
CID 113059276
N-[4-[acetyl-[2-[(4-fluorophenyl)sulfonylamino]ethyl]amino]phenyl]acetamide
CID 113061863
N-[2-[(4-fluorophenyl)sulfonylamino]ethyl]-N-(4-methoxyphenyl)acetamide
CID 113060704
methyl N-[2-(N-acetyl-4-fluoroanilino)ethyl]carbamate
CID 113059341
N-[2-(N,4-diacetylanilino)ethyl]-4-fluorobenzamide
CID 113061648
N-[2-(N-acetyl-4-fluoroanilino)ethyl]-2,2-dimethylpropanamide
CID 113059285
N-(3-chlorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 113059569
N-[2-(methanesulfonamido)ethyl]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 113061471
N-(2-aminoethyl)-N-(4-fluorophenyl)acetamide
CID 28769229
N-[4-(dimethylamino)phenyl]-N-[2-[(4-fluoro-2-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113062231

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide?
The IUPAC name of N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide (CID 113059351) is N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide is CC(=O)N(CCNS(C)(=O)=O)c1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide?
The InChIKey is DCTWKKSTSFGDMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O3S/c1-9(15)14(8-7-13-18(2,16)17)11-5-3-10(12)4-6-11/h3-6,13H,7-8H2,1-2H3.
What are the key properties of N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide?
N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide has a molecular weight of 274.32 g/mol, XLogP of 0.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N-[2-(methanesulfonamido)ethyl]acetamide is sourced from PubChem (CID 113059351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).