N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide

C16H15F2N3O2 — CID 109010043

IUPACN-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CNc2ccc(F)cc2F)cc1
InChIInChI=1S/C16H15F2N3O2/c1-10(22)20-12-3-5-13(6-4-12)21-16(23)9-19-15-7-2-11(17)8-14(15)18/h2-8,19H,9H2,1H3,(H,20,22)(H,21,23)
InChIKeyRMCXANRKVQTIAD-UHFFFAOYSA-N
MW319.31 g/mol
LogP2.97
Rot. Bonds5

About N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide

N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide (PubChem CID 109010043) has the molecular formula C16H15F2N3O2 and a molecular weight of 319.31 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide
PubChem CID109010043
Molecular FormulaC16H15F2N3O2
Molecular Weight319.31 g/mol
Exact Mass319.11
IUPAC NameN-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CNc2ccc(F)cc2F)cc1
InChIInChI=1S/C16H15F2N3O2/c1-10(22)20-12-3-5-13(6-4-12)21-16(23)9-19-15-7-2-11(17)8-14(15)18/h2-8,19H,9H2,1H3,(H,20,22)(H,21,23)
InChIKeyRMCXANRKVQTIAD-UHFFFAOYSA-N
XLogP2.97
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.31
LogP ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-tert-butylphenyl)-2-(2,4-difluoroanilino)acetamide
CID 109008349
N-(4-acetamidophenyl)-3-(2,4-difluoroanilino)propanamide
CID 109041216
2-(2,4-difluoroanilino)-N-(2,4-difluorophenyl)acetamide
CID 109011050
N-(3-bromo-4-methylphenyl)-2-(2,4-difluoroanilino)acetamide
CID 109009001
2-(5-fluoro-2-methylanilino)-N-(4-fluorophenyl)acetamide
CID 9099732
2-(2,4-difluoroanilino)-N-(4-phenylmethoxyphenyl)acetamide
CID 109010754
N'-(2,4-difluorophenyl)-N-(4-fluorophenyl)propanediamide
CID 108954847
2-(5-bromo-4-fluoro-2-methylanilino)-N-(4-fluorophenyl)acetamide
CID 107592105
2-(2-bromo-4-fluoroanilino)-N-(4-chlorophenyl)acetamide
CID 28939364
N-(3-cyanophenyl)-2-(2,4-difluoroanilino)acetamide
CID 109011066
N-(4-methylphenyl)-2-(2,4,5-trifluoroanilino)acetamide
CID 62816420
2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide
CID 28939365

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide (CID 109010043) is N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide is CC(=O)Nc1ccc(NC(=O)CNc2ccc(F)cc2F)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide?
The InChIKey is RMCXANRKVQTIAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2N3O2/c1-10(22)20-12-3-5-13(6-4-12)21-16(23)9-19-15-7-2-11(17)8-14(15)18/h2-8,19H,9H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide?
N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide has a molecular weight of 319.31 g/mol, XLogP of 2.97, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide is sourced from PubChem (CID 109010043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).