2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide

C21H24N2O3 — CID 113175646

IUPAC2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide
SMILESCC(=O)c1ccc(N(CC(=O)Nc2c(C)cc(C)cc2C)C(C)=O)cc1
InChIInChI=1S/C21H24N2O3/c1-13-10-14(2)21(15(3)11-13)22-20(26)12-23(17(5)25)19-8-6-18(7-9-19)16(4)24/h6-11H,12H2,1-5H3,(H,22,26)
InChIKeyAZEASRZKWGOQOJ-UHFFFAOYSA-N
MW352.43 g/mol
LogP3.81
Rot. Bonds5

About 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide

2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide (PubChem CID 113175646) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide
PubChem CID113175646
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide
SMILESCC(=O)c1ccc(N(CC(=O)Nc2c(C)cc(C)cc2C)C(C)=O)cc1
InChIInChI=1S/C21H24N2O3/c1-13-10-14(2)21(15(3)11-13)22-20(26)12-23(17(5)25)19-8-6-18(7-9-19)16(4)24/h6-11H,12H2,1-5H3,(H,22,26)
InChIKeyAZEASRZKWGOQOJ-UHFFFAOYSA-N
XLogP3.81
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-acetyl-3,5-dimethylanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 113168537
2-(N,4-diacetylanilino)-N-(2,5-dimethylphenyl)acetamide
CID 113175635
2-(N-acetyl-3,4-dimethoxyanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 113174903
2-(N-acetyl-3,5-dimethylanilino)-N-(4-acetylphenyl)acetamide
CID 113168572
2-(4-acetamido-N-acetylanilino)-N-(2-chloro-4,6-dimethylphenyl)acetamide
CID 113175984
2-(N-acetyl-3-chloroanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 113171389
2-(N,4-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113175648
2-(N,4-diacetylanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 113175717
2-[N-acetyl-4-(trifluoromethyl)anilino]-N-(2-chloro-4,6-dimethylphenyl)acetamide
CID 113175336
2-[N-acetyl-4-(dimethylamino)anilino]-N-(2,6-dimethylphenyl)acetamide
CID 113176737
2-(N-acetyl-4-pyrrolidin-1-ylanilino)-N-(2-chloro-4,6-dimethylphenyl)acetamide
CID 113177050
2-(N-acetyl-3-methylanilino)-N-(2-chloro-4,6-dimethylphenyl)acetamide
CID 113167577

Frequently Asked Questions

What is the IUPAC name of 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide?
The IUPAC name of 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide (CID 113175646) is 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide.
What is the SMILES notation for 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide?
The canonical SMILES for 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide is CC(=O)c1ccc(N(CC(=O)Nc2c(C)cc(C)cc2C)C(C)=O)cc1.
What is the InChIKey of 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide?
The InChIKey is AZEASRZKWGOQOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-13-10-14(2)21(15(3)11-13)22-20(26)12-23(17(5)25)19-8-6-18(7-9-19)16(4)24/h6-11H,12H2,1-5H3,(H,22,26).
What are the key properties of 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide?
2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide has a molecular weight of 352.43 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N,4-diacetylanilino)-N-(2,4,6-trimethylphenyl)acetamide is sourced from PubChem (CID 113175646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).