2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide

C21H26N2O2 — CID 113169312

IUPAC2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide
SMILESCCc1ccc(N(CC(=O)Nc2ccc(C(C)C)cc2)C(C)=O)cc1
InChIInChI=1S/C21H26N2O2/c1-5-17-6-12-20(13-7-17)23(16(4)24)14-21(25)22-19-10-8-18(9-11-19)15(2)3/h6-13,15H,5,14H2,1-4H3,(H,22,25)
InChIKeyPOPUEEPFCMVGKX-UHFFFAOYSA-N
MW338.45 g/mol
LogP4.36
Rot. Bonds6

About 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide

2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide (PubChem CID 113169312) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide
PubChem CID113169312
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC Name2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide
SMILESCCc1ccc(N(CC(=O)Nc2ccc(C(C)C)cc2)C(C)=O)cc1
InChIInChI=1S/C21H26N2O2/c1-5-17-6-12-20(13-7-17)23(16(4)24)14-21(25)22-19-10-8-18(9-11-19)15(2)3/h6-13,15H,5,14H2,1-4H3,(H,22,25)
InChIKeyPOPUEEPFCMVGKX-UHFFFAOYSA-N
XLogP4.36
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)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-(4-acetamido-N-acetylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113175968
3-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)propanamide
CID 113125426
2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide
CID 113169827
2-(N-acetyl-4-methoxyanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113173591
2-(N-acetyl-4-ethylanilino)-N-(4-tert-butylphenyl)acetamide
CID 113169317
2-(N-acetyl-3-fluoroanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113177670
2-(N-acetyl-4-ethylanilino)-N-(3,5-dimethylphenyl)acetamide
CID 113169304
2-(N-acetyl-3,4-difluoroanilino)-N-(4-ethylphenyl)acetamide
CID 113181652
2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-N-(4-propan-2-ylphenyl)acetamide
CID 113178476
2-(N-acetyl-4-ethylanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 113169343
2-(N-acetyl-3-bromoanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113177946
methyl 3-[[2-(N-acetyl-4-propan-2-ylanilino)acetyl]amino]benzoate
CID 113169884

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide (CID 113169312) is 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide is CCc1ccc(N(CC(=O)Nc2ccc(C(C)C)cc2)C(C)=O)cc1.
What is the InChIKey of 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide?
The InChIKey is POPUEEPFCMVGKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2/c1-5-17-6-12-20(13-7-17)23(16(4)24)14-21(25)22-19-10-8-18(9-11-19)15(2)3/h6-13,15H,5,14H2,1-4H3,(H,22,25).
What are the key properties of 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide?
2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide has a molecular weight of 338.45 g/mol, XLogP of 4.36, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 113169312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).