2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide

C17H16F2N2O2 — CID 113167823

IUPAC2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(F)cc1F)c1ccc(C)cc1
InChIInChI=1S/C17H16F2N2O2/c1-11-3-6-14(7-4-11)21(12(2)22)10-17(23)20-16-8-5-13(18)9-15(16)19/h3-9H,10H2,1-2H3,(H,20,23)
InChIKeyVSKZAMOAKQITFJ-UHFFFAOYSA-N
MW318.32 g/mol
LogP3.26
Rot. Bonds4

About 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide

2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide (PubChem CID 113167823) has the molecular formula C17H16F2N2O2 and a molecular weight of 318.32 g/mol. Its IUPAC name is 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide
PubChem CID113167823
Molecular FormulaC17H16F2N2O2
Molecular Weight318.32 g/mol
Exact Mass318.12
IUPAC Name2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(F)cc1F)c1ccc(C)cc1
InChIInChI=1S/C17H16F2N2O2/c1-11-3-6-14(7-4-11)21(12(2)22)10-17(23)20-16-8-5-13(18)9-15(16)19/h3-9H,10H2,1-2H3,(H,20,23)
InChIKeyVSKZAMOAKQITFJ-UHFFFAOYSA-N
XLogP3.26
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.32
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(N-acetyl-4-ethylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113169375
2-(N-acetylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113167233
2-[N-acetyl-4-(diethylamino)anilino]-N-(2,4-difluorophenyl)acetamide
CID 113176939
2-(N-acetyl-2,4-difluoroanilino)-N-(2,4-difluorophenyl)acetamide
CID 113179083
2-(N-acetyl-4-pyrrolidin-1-ylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113177074
2-(N,3-diacetylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113175525
2-(N-acetyl-2-methylanilino)-N-(2,4-difluorophenyl)acetamide
CID 113167429
2-(N-acetyl-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide
CID 113171081
3-(N-acetyl-4-ethylanilino)-N-(2,4-difluorophenyl)propanamide
CID 113125479
2-(N-acetyl-4-fluoroanilino)-N-(4-fluorophenyl)acetamide
CID 113171016
2-(N-acetyl-4-methylanilino)-N-(2-methoxyphenyl)acetamide
CID 113167779
ethyl 4-[acetyl-[3-(2,4-difluoroanilino)-3-oxopropyl]amino]benzoate
CID 113133381

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide?
The IUPAC name of 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide (CID 113167823) is 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide is CC(=O)N(CC(=O)Nc1ccc(F)cc1F)c1ccc(C)cc1.
What is the InChIKey of 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide?
The InChIKey is VSKZAMOAKQITFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F2N2O2/c1-11-3-6-14(7-4-11)21(12(2)22)10-17(23)20-16-8-5-13(18)9-15(16)19/h3-9H,10H2,1-2H3,(H,20,23).
What are the key properties of 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide?
2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide has a molecular weight of 318.32 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-methylanilino)-N-(2,4-difluorophenyl)acetamide is sourced from PubChem (CID 113167823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).