N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide

C14H15FN2O3S2 — CID 3245041

IUPACN-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
SMILESCc1ccc(NC(=O)CN(C)S(=O)(=O)c2cccs2)cc1F
InChIInChI=1S/C14H15FN2O3S2/c1-10-5-6-11(8-12(10)15)16-13(18)9-17(2)22(19,20)14-4-3-7-21-14/h3-8H,9H2,1-2H3,(H,16,18)
InChIKeyNLHBELIUEUKJGI-UHFFFAOYSA-N
MW342.42 g/mol
LogP2.45
Rot. Bonds5

About N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide

N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide (PubChem CID 3245041) has the molecular formula C14H15FN2O3S2 and a molecular weight of 342.42 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
PubChem CID3245041
Molecular FormulaC14H15FN2O3S2
Molecular Weight342.42 g/mol
Exact Mass342.05
IUPAC NameN-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
SMILESCc1ccc(NC(=O)CN(C)S(=O)(=O)c2cccs2)cc1F
InChIInChI=1S/C14H15FN2O3S2/c1-10-5-6-11(8-12(10)15)16-13(18)9-17(2)22(19,20)14-4-3-7-21-14/h3-8H,9H2,1-2H3,(H,16,18)
InChIKeyNLHBELIUEUKJGI-UHFFFAOYSA-N
XLogP2.45
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(dimethylsulfamoyl)phenyl]-2-thiophen-3-ylacetamide
CID 4805705
N-(2-fluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide
CID 8965775
N-(4-fluorophenyl)-1-(thiophene-2-sulfonyl)piperidine-4-carboxamide
CID 2053794
N-(4-methylphenyl)-1-(thien-2-ylsulfonyl)piperidine-3-carboxamide
CID 3240002
N~1~-(2-fluorophenyl)-N~3~-(thien-2-ylsulfonyl)-beta-alaninamide
CID 3244623
N~1~-(3-Methylphenyl)-2-[methyl(2-thienylsulfonyl)amino]acetamide
CID 4318852
N-[4-(Diethylamino)-2-methylphenyl]-3-methyl-2-(thiophene-2-sulfonamido)butanamide
CID 15988648
1-[4-[3-fluoro-4-[[(3S,6R)-3-methyl-1,1-dioxo-6-thiophen-3-ylthiazinan-2-yl]methyl]phenyl]piperazin-1-yl]ethanone
CID 122644619
N-(3-Ethylphenyl)-3-phenyl-2-(thiophene-2-sulfonamido)propanamide
CID 15987880
N-Ethyl-2-[(4-methylsulfanyl-benzenesulfonyl)-p-tolyl-amino]-acetamide
CID 653351
(E)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-thiophen-2-ylprop-2-enamide
CID 2423320
N-(3,4-difluorophenyl)-1-(thiophen-2-ylsulfonyl)piperidine-4-carboxamide
CID 2506798

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide (CID 3245041) is N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide is Cc1ccc(NC(=O)CN(C)S(=O)(=O)c2cccs2)cc1F.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide?
The InChIKey is NLHBELIUEUKJGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O3S2/c1-10-5-6-11(8-12(10)15)16-13(18)9-17(2)22(19,20)14-4-3-7-21-14/h3-8H,9H2,1-2H3,(H,16,18).
What are the key properties of N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide?
N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide has a molecular weight of 342.42 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methylphenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide is sourced from PubChem (CID 3245041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).