2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide

C20H24N2O4 — CID 113174587

IUPAC2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide
SMILESCOc1ccc(OC)c(N(CC(=O)Nc2c(C)cccc2C)C(C)=O)c1
InChIInChI=1S/C20H24N2O4/c1-13-7-6-8-14(2)20(13)21-19(24)12-22(15(3)23)17-11-16(25-4)9-10-18(17)26-5/h6-11H,12H2,1-5H3,(H,21,24)
InChIKeyFZLDSFUDIJDRLI-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.31
Rot. Bonds6

About 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide

2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide (PubChem CID 113174587) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide
PubChem CID113174587
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide
SMILESCOc1ccc(OC)c(N(CC(=O)Nc2c(C)cccc2C)C(C)=O)c1
InChIInChI=1S/C20H24N2O4/c1-13-7-6-8-14(2)20(13)21-19(24)12-22(15(3)23)17-11-16(25-4)9-10-18(17)26-5/h6-11H,12H2,1-5H3,(H,21,24)
InChIKeyFZLDSFUDIJDRLI-UHFFFAOYSA-N
XLogP3.31
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dichlorophenyl)acetamide
CID 113174647
2-(N-acetyl-2,5-dimethoxyanilino)-N-(3-fluorophenyl)acetamide
CID 113174637
2-(N-acetyl-2-methylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 113167394
3-(N-acetyl-2,5-dimethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 113130022
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,3-dichlorophenyl)acetamide
CID 113174648
3-(N-acetyl-2,5-dimethoxyanilino)-N-(2,4,6-trimethylphenyl)propanamide
CID 113130020
2-(N-acetyl-2-methoxy-5-methylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 113174146
2-(N-acetyl-2-methoxy-5-methylanilino)-N-(2,6-dichlorophenyl)acetamide
CID 113174178
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-ethoxyphenyl)acetamide
CID 113174616
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide
CID 113174598
2-(N-acetyl-2-methoxy-5-methylanilino)-N-(2,3-dimethylphenyl)acetamide
CID 113174112
2-(N-acetyl-2,5-dimethoxyanilino)-N-(1-phenylethyl)acetamide
CID 113174532

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide (CID 113174587) is 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide is COc1ccc(OC)c(N(CC(=O)Nc2c(C)cccc2C)C(C)=O)c1.
What is the InChIKey of 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide?
The InChIKey is FZLDSFUDIJDRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-13-7-6-8-14(2)20(13)21-19(24)12-22(15(3)23)17-11-16(25-4)9-10-18(17)26-5/h6-11H,12H2,1-5H3,(H,21,24).
What are the key properties of 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide?
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide has a molecular weight of 356.42 g/mol, XLogP of 3.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide is sourced from PubChem (CID 113174587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).