2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide

C20H24N2O3 — CID 113173935

IUPAC2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide
SMILESCCOc1ccc(N(CC(=O)Nc2cc(C)ccc2C)C(C)=O)cc1
InChIInChI=1S/C20H24N2O3/c1-5-25-18-10-8-17(9-11-18)22(16(4)23)13-20(24)21-19-12-14(2)6-7-15(19)3/h6-12H,5,13H2,1-4H3,(H,21,24)
InChIKeyNHKMPAQGFYFUAE-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.69
Rot. Bonds6

About 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide

2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide (PubChem CID 113173935) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide
PubChem CID113173935
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide
SMILESCCOc1ccc(N(CC(=O)Nc2cc(C)ccc2C)C(C)=O)cc1
InChIInChI=1S/C20H24N2O3/c1-5-25-18-10-8-17(9-11-18)22(16(4)23)13-20(24)21-19-12-14(2)6-7-15(19)3/h6-12H,5,13H2,1-4H3,(H,21,24)
InChIKeyNHKMPAQGFYFUAE-UHFFFAOYSA-N
XLogP3.69
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N,4-diacetylanilino)-N-(2,5-dimethylphenyl)acetamide
CID 113175635
2-(N-acetyl-4-ethoxyanilino)-N-(3,4-dimethylphenyl)acetamide
CID 113173936
2-(N-acetyl-2-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide
CID 113173765
2-(N-acetyl-4-ethoxyanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 113174007
2-(4-acetamido-N-acetylanilino)-N-(4-ethoxyphenyl)acetamide
CID 113175991
2-(N-acetyl-2,4-dimethylanilino)-N-(2,5-dimethylphenyl)acetamide
CID 113167944
N-(2,5-dimethylphenyl)-4-(4-ethoxyphenoxy)butanamide
CID 7991934
N-(2,5-dimethylphenyl)-2-(4-ethoxy-N-(4-fluorophenyl)sulfonylanilino)acetamide
CID 53280294
2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-N-(2,5-dimethylphenyl)acetamide
CID 113178466
2-(N-acetyl-4-chloroanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 113171587
2-(N-acetyl-4-ethoxyanilino)-N-butylacetamide
CID 113173852
2-(N-acetyl-4-ethoxyanilino)-N-(2,6-dichlorophenyl)acetamide
CID 113174005

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide (CID 113173935) is 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide is CCOc1ccc(N(CC(=O)Nc2cc(C)ccc2C)C(C)=O)cc1.
What is the InChIKey of 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide?
The InChIKey is NHKMPAQGFYFUAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-5-25-18-10-8-17(9-11-18)22(16(4)23)13-20(24)21-19-12-14(2)6-7-15(19)3/h6-12H,5,13H2,1-4H3,(H,21,24).
What are the key properties of 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide?
2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide has a molecular weight of 340.42 g/mol, XLogP of 3.69, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-ethoxyanilino)-N-(2,5-dimethylphenyl)acetamide is sourced from PubChem (CID 113173935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).