2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide

C16H13Cl2FN2O2 — CID 113170882

IUPAC2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1F
InChIInChI=1S/C16H13Cl2FN2O2/c1-10(22)21(15-5-3-2-4-14(15)19)9-16(23)20-11-6-7-12(17)13(18)8-11/h2-8H,9H2,1H3,(H,20,23)
InChIKeyPZYJCIGIJAOMJS-UHFFFAOYSA-N
MW355.20 g/mol
LogP4.12
Rot. Bonds4

About 2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide

2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide (PubChem CID 113170882) has the molecular formula C16H13Cl2FN2O2 and a molecular weight of 355.20 g/mol. Its IUPAC name is 2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide
PubChem CID113170882
Molecular FormulaC16H13Cl2FN2O2
Molecular Weight355.20 g/mol
Exact Mass354.03
IUPAC Name2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1F
InChIInChI=1S/C16H13Cl2FN2O2/c1-10(22)21(15-5-3-2-4-14(15)19)9-16(23)20-11-6-7-12(17)13(18)8-11/h2-8H,9H2,1H3,(H,20,23)
InChIKeyPZYJCIGIJAOMJS-UHFFFAOYSA-N
XLogP4.12
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.20
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[acetyl-[2-(3,4-dichloroanilino)-2-oxoethyl]amino]benzoate
CID 113176174
2-(N-acetyl-2-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 113170796
2-(N-acetyl-2,3-dichloroanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 113180172
2-(N-acetyl-2-fluoroanilino)-N-(1,3-benzodioxol-5-yl)acetamide
CID 113170871
N-(4-acetamidophenyl)-2-(N-acetyl-2-chloroanilino)acetamide
CID 113171239
2-(N-acetyl-2-fluoroanilino)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 113170844
2-(N-acetyl-2,3,4-trifluoroanilino)-N-(3-chloro-4-fluorophenyl)acetamide
CID 113181321
2-(N-acetyl-3-chloro-2-methylanilino)-N-(3,4-difluorophenyl)acetamide
CID 113171824
2-(N-acetyl-2,6-dimethylanilino)-N-(3,4-dichlorophenyl)acetamide
CID 113168799
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
2-(N-acetyl-2-ethylanilino)-N-(3,4-difluorophenyl)acetamide
CID 113169203

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide (CID 113170882) is 2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide is CC(=O)N(CC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1F.
What is the InChIKey of 2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide?
The InChIKey is PZYJCIGIJAOMJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Cl2FN2O2/c1-10(22)21(15-5-3-2-4-14(15)19)9-16(23)20-11-6-7-12(17)13(18)8-11/h2-8H,9H2,1H3,(H,20,23).
What are the key properties of 2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide?
2-(N-acetyl-2-fluoroanilino)-N-(3,4-dichlorophenyl)acetamide has a molecular weight of 355.20 g/mol, XLogP of 4.12, 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-(3,4-dichlorophenyl)acetamide is sourced from PubChem (CID 113170882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).