2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide

C16H17FN2O3S — CID 113093511

IUPAC2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide
SMILESCN(c1ccccc1NC(=O)Cc1cccc(F)c1)S(C)(=O)=O
InChIInChI=1S/C16H17FN2O3S/c1-19(23(2,21)22)15-9-4-3-8-14(15)18-16(20)11-12-6-5-7-13(17)10-12/h3-10H,11H2,1-2H3,(H,18,20)
InChIKeyOQCULJOOWLBESR-UHFFFAOYSA-N
MW336.39 g/mol
LogP2.40
Rot. Bonds5

About 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide

2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide (PubChem CID 113093511) has the molecular formula C16H17FN2O3S and a molecular weight of 336.39 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide
PubChem CID113093511
Molecular FormulaC16H17FN2O3S
Molecular Weight336.39 g/mol
Exact Mass336.09
IUPAC Name2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide
SMILESCN(c1ccccc1NC(=O)Cc1cccc(F)c1)S(C)(=O)=O
InChIInChI=1S/C16H17FN2O3S/c1-19(23(2,21)22)15-9-4-3-8-14(15)18-16(20)11-12-6-5-7-13(17)10-12/h3-10H,11H2,1-2H3,(H,18,20)
InChIKeyOQCULJOOWLBESR-UHFFFAOYSA-N
XLogP2.40
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide
CID 166403944
N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide
CID 113093104
2-(3-fluorophenyl)-N-(3-hydroxy-2-methylphenyl)acetamide
CID 64793447
2-(3-chlorophenyl)-N-[2-(dimethylamino)phenyl]acetamide
CID 53384824
N-[2-(2-ethyl-N-methylsulfonylanilino)ethyl]-2-(3-fluorophenyl)acetamide
CID 113069197
N-[2-(2-chloroanilino)-2-oxoethyl]-2-(3-fluorophenyl)-N-methylacetamide
CID 38632222
2-(3-fluorophenyl)-N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]acetamide
CID 38763351
N-[2-[acetyl(methyl)amino]phenyl]-2-(3-methylphenyl)acetamide
CID 113093793
N-(5-bromo-4-fluoro-2-methylphenyl)-2-(3-fluorophenyl)acetamide
CID 103274575
2-(3-fluorophenyl)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 24525372
N-(5-fluoro-2-methoxyphenyl)-2-(3-fluorophenyl)acetamide
CID 110776591
N-[2-[cyclopropyl(methylsulfonyl)amino]-5-fluorophenyl]-2-(3-methylphenyl)acetamide
CID 113093287

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide (CID 113093511) is 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide is CN(c1ccccc1NC(=O)Cc1cccc(F)c1)S(C)(=O)=O.
What is the InChIKey of 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide?
The InChIKey is OQCULJOOWLBESR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O3S/c1-19(23(2,21)22)15-9-4-3-8-14(15)18-16(20)11-12-6-5-7-13(17)10-12/h3-10H,11H2,1-2H3,(H,18,20).
What are the key properties of 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide?
2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide has a molecular weight of 336.39 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide is sourced from PubChem (CID 113093511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).