3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide

C18H19FN2O3 — CID 86992293

IUPAC3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide
SMILESCc1ccc(OCC(=O)Nc2cc(C(N)=O)cc(F)c2C)c(C)c1
InChIInChI=1S/C18H19FN2O3/c1-10-4-5-16(11(2)6-10)24-9-17(22)21-15-8-13(18(20)23)7-14(19)12(15)3/h4-8H,9H2,1-3H3,(H2,20,23)(H,21,22)
InChIKeyFDBGXGROMANDNN-UHFFFAOYSA-N
MW330.36 g/mol
LogP2.87
Rot. Bonds5

About 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide

3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide (PubChem CID 86992293) has the molecular formula C18H19FN2O3 and a molecular weight of 330.36 g/mol. Its IUPAC name is 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide.

Molecular Properties

Compound Name3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide
PubChem CID86992293
Molecular FormulaC18H19FN2O3
Molecular Weight330.36 g/mol
Exact Mass330.14
IUPAC Name3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide
SMILESCc1ccc(OCC(=O)Nc2cc(C(N)=O)cc(F)c2C)c(C)c1
InChIInChI=1S/C18H19FN2O3/c1-10-4-5-16(11(2)6-10)24-9-17(22)21-15-8-13(18(20)23)7-14(19)12(15)3/h4-8H,9H2,1-3H3,(H2,20,23)(H,21,22)
InChIKeyFDBGXGROMANDNN-UHFFFAOYSA-N
XLogP2.87
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide 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

3-[[2-(2-ethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide
CID 86992288
N-(3-amino-2-methylphenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 16781912
3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-4-methoxybenzoic acid
CID 28675994
2-[2-(2-fluoro-4-methylanilino)-2-oxoethoxy]-4-methylbenzamide
CID 24585355
2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 7809229
2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxamide
CID 969209
2-(2,4-dimethylphenoxy)-N-(2-sulfanylphenyl)acetamide
CID 23932880
N-(2,5-dihydroxyphenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 59933606
N-(3-chloro-4-fluorophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 800993
N-(2-cyanophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 876328
2-(2,4-dimethylphenoxy)-N-methylacetamide
CID 965410
2-(4-chloro-2-methylphenoxy)-N-(2-chloro-4-methylphenyl)acetamide
CID 7926730

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide?
The IUPAC name of 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide (CID 86992293) is 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide.
What is the SMILES notation for 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide?
The canonical SMILES for 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide is Cc1ccc(OCC(=O)Nc2cc(C(N)=O)cc(F)c2C)c(C)c1.
What is the InChIKey of 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide?
The InChIKey is FDBGXGROMANDNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3/c1-10-4-5-16(11(2)6-10)24-9-17(22)21-15-8-13(18(20)23)7-14(19)12(15)3/h4-8H,9H2,1-3H3,(H2,20,23)(H,21,22).
What are the key properties of 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide?
3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide has a molecular weight of 330.36 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(2,4-dimethylphenoxy)acetyl]amino]-5-fluoro-4-methylbenzamide is sourced from PubChem (CID 86992293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).