2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide

C17H17FN2O2 — CID 113170796

IUPAC2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(C)cc1)c1ccccc1F
InChIInChI=1S/C17H17FN2O2/c1-12-7-9-14(10-8-12)19-17(22)11-20(13(2)21)16-6-4-3-5-15(16)18/h3-10H,11H2,1-2H3,(H,19,22)
InChIKeyAFMOVEQTAFJARB-UHFFFAOYSA-N
MW300.33 g/mol
LogP3.13
Rot. Bonds4

About 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide

2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide (PubChem CID 113170796) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide
PubChem CID113170796
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC Name2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(C)cc1)c1ccccc1F
InChIInChI=1S/C17H17FN2O2/c1-12-7-9-14(10-8-12)19-17(22)11-20(13(2)21)16-6-4-3-5-15(16)18/h3-10H,11H2,1-2H3,(H,19,22)
InChIKeyAFMOVEQTAFJARB-UHFFFAOYSA-N
XLogP3.13
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide
CID 113170882
2-(N-acetyl-2-fluoroanilino)-N-(1,3-benzodioxol-5-yl)acetamide
CID 113170871
2-(N-acetyl-2-fluoroanilino)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 113170844
2-(N-acetyl-2,5-dimethylanilino)-N-phenylacetamide
CID 113168130
2-(N-acetyl-5-chloro-2-methylanilino)-N-(4-methylphenyl)acetamide
CID 113171908
2-(N-acetyl-2-fluoroanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 113170823
2-(N-acetyl-2-fluoroanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113170822
methyl 2-[acetyl-[2-(4-fluoroanilino)-2-oxoethyl]amino]benzoate
CID 113176131
2-(N-acetyl-2-ethylanilino)-N-(3,4-difluorophenyl)acetamide
CID 113169203
3-(N-acetyl-2-fluoroanilino)-N-(3,5-dimethylphenyl)propanamide
CID 113126725
N-(4-acetamidophenyl)-2-(N-acetyl-2-chloroanilino)acetamide
CID 113171239
2-(N-acetyl-2,6-difluoroanilino)-N-(4-fluorophenyl)acetamide
CID 113181479

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide (CID 113170796) is 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide is CC(=O)N(CC(=O)Nc1ccc(C)cc1)c1ccccc1F.
What is the InChIKey of 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide?
The InChIKey is AFMOVEQTAFJARB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2/c1-12-7-9-14(10-8-12)19-17(22)11-20(13(2)21)16-6-4-3-5-15(16)18/h3-10H,11H2,1-2H3,(H,19,22).
What are the key properties of 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide?
2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide has a molecular weight of 300.33 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 113170796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).