2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide

C22H28N2O4 — CID 113174598

IUPAC2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide
SMILESCOc1ccc(OC)c(N(CC(=O)Nc2ccccc2C(C)(C)C)C(C)=O)c1
InChIInChI=1S/C22H28N2O4/c1-15(25)24(19-13-16(27-5)11-12-20(19)28-6)14-21(26)23-18-10-8-7-9-17(18)22(2,3)4/h7-13H,14H2,1-6H3,(H,23,26)
InChIKeyVPOMFDLAESVSCS-UHFFFAOYSA-N
MW384.48 g/mol
LogP3.99
Rot. Bonds6

About 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide

2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide (PubChem CID 113174598) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide
PubChem CID113174598
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide
SMILESCOc1ccc(OC)c(N(CC(=O)Nc2ccccc2C(C)(C)C)C(C)=O)c1
InChIInChI=1S/C22H28N2O4/c1-15(25)24(19-13-16(27-5)11-12-20(19)28-6)14-21(26)23-18-10-8-7-9-17(18)22(2,3)4/h7-13H,14H2,1-6H3,(H,23,26)
InChIKeyVPOMFDLAESVSCS-UHFFFAOYSA-N
XLogP3.99
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)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

2-(N-acetyl-5-chloro-2-methoxyanilino)-N-(2-tert-butylphenyl)acetamide
CID 113172867
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-ethoxyphenyl)acetamide
CID 113174616
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,3-dichlorophenyl)acetamide
CID 113174648
2-(N-acetyl-2-methoxy-5-methylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 113174146
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide
CID 113174587
2-(N-acetyl-2-methylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 113167394
2-(N-acetyl-2-ethylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 113169147
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dichlorophenyl)acetamide
CID 113174647
N-(2-tert-butylphenyl)-2-(2,4-dimethoxyanilino)acetamide
CID 30567589
N-(2-tert-butylphenyl)-3-(2,5-dimethoxyanilino)propanamide
CID 109037265
2-(N-acetyl-2,5-dimethoxyanilino)-N-(3-fluorophenyl)acetamide
CID 113174637
2-(N-acetyl-2,4-dichloroanilino)-N-(2-tert-butylphenyl)acetamide
CID 113179625

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide (CID 113174598) is 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide is COc1ccc(OC)c(N(CC(=O)Nc2ccccc2C(C)(C)C)C(C)=O)c1.
What is the InChIKey of 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide?
The InChIKey is VPOMFDLAESVSCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c1-15(25)24(19-13-16(27-5)11-12-20(19)28-6)14-21(26)23-18-10-8-7-9-17(18)22(2,3)4/h7-13H,14H2,1-6H3,(H,23,26).
What are the key properties of 2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide?
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2-tert-butylphenyl)acetamide has a molecular weight of 384.48 g/mol, XLogP of 3.99, 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-tert-butylphenyl)acetamide is sourced from PubChem (CID 113174598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).