N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide

C17H16F2N2O3 — CID 131890166

IUPACN-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide
SMILESCC(=O)Nc1ccc(C)cc1NC(=O)COc1ccc(F)cc1F
InChIInChI=1S/C17H16F2N2O3/c1-10-3-5-14(20-11(2)22)15(7-10)21-17(23)9-24-16-6-4-12(18)8-13(16)19/h3-8H,9H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyBOXDHRZUDYHQCK-UHFFFAOYSA-N
MW334.32 g/mol
LogP3.25
Rot. Bonds5

About N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide

N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide (PubChem CID 131890166) has the molecular formula C17H16F2N2O3 and a molecular weight of 334.32 g/mol. Its IUPAC name is N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide
PubChem CID131890166
Molecular FormulaC17H16F2N2O3
Molecular Weight334.32 g/mol
Exact Mass334.11
IUPAC NameN-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide
SMILESCC(=O)Nc1ccc(C)cc1NC(=O)COc1ccc(F)cc1F
InChIInChI=1S/C17H16F2N2O3/c1-10-3-5-14(20-11(2)22)15(7-10)21-17(23)9-24-16-6-4-12(18)8-13(16)19/h3-8H,9H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyBOXDHRZUDYHQCK-UHFFFAOYSA-N
XLogP3.25
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.32
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)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

N-(2-fluoro-4-methylphenyl)-2-(2-fluorophenoxy)acetamide
CID 7815061
2-(4-bromo-2-fluorophenoxy)-N-(2,4-difluorophenyl)acetamide
CID 2523027
2-(4-bromo-2-fluorophenoxy)-N-(2-bromo-4-methylphenyl)acetamide
CID 26524063
N-(2,4-difluorophenyl)-2-(4-methylphenoxy)acetamide
CID 755254
2-(2,4-difluorophenoxy)-N-(2-hydroxyphenyl)acetamide
CID 31984086
2-(2,4-difluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 580280
2-(2,5-dimethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 35728477
2-(4-chloro-2-methylphenoxy)-N-(2,4-difluorophenyl)acetamide
CID 3945608
2-(2,4-difluorophenoxy)-N-(2,5-dimethoxyphenyl)acetamide
CID 39908076
N-(2-chloro-4-fluorophenyl)-2-(2-methoxy-4-methylphenoxy)acetamide
CID 18165666
N-(2-chlorophenyl)-2-(2,4-difluorophenoxy)acetamide
CID 31854987
N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)propanediamide
CID 108955812

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide?
The IUPAC name of N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide (CID 131890166) is N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide.
What is the SMILES notation for N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide?
The canonical SMILES for N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide is CC(=O)Nc1ccc(C)cc1NC(=O)COc1ccc(F)cc1F.
What is the InChIKey of N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide?
The InChIKey is BOXDHRZUDYHQCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16F2N2O3/c1-10-3-5-14(20-11(2)22)15(7-10)21-17(23)9-24-16-6-4-12(18)8-13(16)19/h3-8H,9H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide?
N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide has a molecular weight of 334.32 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamido-5-methylphenyl)-2-(2,4-difluorophenoxy)acetamide is sourced from PubChem (CID 131890166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).