N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide

C17H19FN2O3S — CID 113093104

IUPACN-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2cc(F)ccc2N(C)S(C)(=O)=O)cc1
InChIInChI=1S/C17H19FN2O3S/c1-12-4-6-13(7-5-12)10-17(21)19-15-11-14(18)8-9-16(15)20(2)24(3,22)23/h4-9,11H,10H2,1-3H3,(H,19,21)
InChIKeyPUAZKJNXQACMIH-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.71
Rot. Bonds5

About N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide

N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide (PubChem CID 113093104) has the molecular formula C17H19FN2O3S and a molecular weight of 350.42 g/mol. Its IUPAC name is N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide
PubChem CID113093104
Molecular FormulaC17H19FN2O3S
Molecular Weight350.42 g/mol
Exact Mass350.11
IUPAC NameN-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2cc(F)ccc2N(C)S(C)(=O)=O)cc1
InChIInChI=1S/C17H19FN2O3S/c1-12-4-6-13(7-5-12)10-17(21)19-15-11-14(18)8-9-16(15)20(2)24(3,22)23/h4-9,11H,10H2,1-3H3,(H,19,21)
InChIKeyPUAZKJNXQACMIH-UHFFFAOYSA-N
XLogP2.71
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-fluorophenyl)-N-[2-[methyl(methylsulfonyl)amino]phenyl]acetamide
CID 113093511
N-(2-bromo-5-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 103753599
1-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-3-propan-2-ylurea
CID 113093112
N-[2-[cyclopropyl(methylsulfonyl)amino]-5-fluorophenyl]-2-(3-methylphenyl)acetamide
CID 113093287
N-[2-(dimethylamino)-5-fluorophenyl]-2-(4-methylphenoxy)acetamide
CID 113092503
N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]oxane-4-carboxamide
CID 113093111
2-chloro-6-fluoro-N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]benzamide
CID 113093094
N-(4-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 889367
N-[5-fluoro-2-(methanesulfonamido)phenyl]-2-phenylacetamide
CID 113093344
2-[4-[methyl(methylsulfonyl)amino]phenyl]-N-(2,4,6-trimethylphenyl)acetamide
CID 100787274
N-(5-chloro-2-methylphenyl)-2-[4-[methyl(methylsulfonyl)amino]phenyl]acetamide
CID 100787113
N-[5-fluoro-2-(methanesulfonamido)phenyl]-2-(4-methoxyphenyl)acetamide
CID 113093347

Frequently Asked Questions

What is the IUPAC name of N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide (CID 113093104) is N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)Nc2cc(F)ccc2N(C)S(C)(=O)=O)cc1.
What is the InChIKey of N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide?
The InChIKey is PUAZKJNXQACMIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O3S/c1-12-4-6-13(7-5-12)10-17(21)19-15-11-14(18)8-9-16(15)20(2)24(3,22)23/h4-9,11H,10H2,1-3H3,(H,19,21).
What are the key properties of N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide?
N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide has a molecular weight of 350.42 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-fluoro-2-[methyl(methylsulfonyl)amino]phenyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 113093104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).