2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide

C22H26N2O3 — CID 113175474

IUPAC2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
SMILESCC(=O)c1cccc(N(CC(=O)Nc2c(C)cccc2C(C)C)C(C)=O)c1
InChIInChI=1S/C22H26N2O3/c1-14(2)20-11-6-8-15(3)22(20)23-21(27)13-24(17(5)26)19-10-7-9-18(12-19)16(4)25/h6-12,14H,13H2,1-5H3,(H,23,27)
InChIKeyRSSKJZPSKAHDIB-UHFFFAOYSA-N
MW366.46 g/mol
LogP4.31
Rot. Bonds6

About 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide

2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide (PubChem CID 113175474) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
PubChem CID113175474
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC Name2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
SMILESCC(=O)c1cccc(N(CC(=O)Nc2c(C)cccc2C(C)C)C(C)=O)c1
InChIInChI=1S/C22H26N2O3/c1-14(2)20-11-6-8-15(3)22(20)23-21(27)13-24(17(5)26)19-10-7-9-18(12-19)16(4)25/h6-12,14H,13H2,1-5H3,(H,23,27)
InChIKeyRSSKJZPSKAHDIB-UHFFFAOYSA-N
XLogP4.31
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(N,3-diacetylanilino)-N-(2-methyl-6-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-(N,4-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113175648
2-(N-acetyl-3-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113167564
2-(N-acetyl-3-cyanoanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113180931
2-(N-acetyl-3,4-dichloroanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113179490
2-(N-acetyl-4-propan-2-yloxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113174441
2-(N-acetyl-2,6-difluoroanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113181475
2-(N,3-diacetylanilino)-N-(3,4-dimethylphenyl)acetamide
CID 113175462
3-(N,4-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 113130872
2-(N-acetyl-2-ethyl-6-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113169502
2-(N-acetyl-2,4-dichloroanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113179624
2-(N,3-diacetylanilino)-N-phenylacetamide
CID 113175453
2-(N-acetyl-2-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 113173778

Frequently Asked Questions

What is the IUPAC name of 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide (CID 113175474) is 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide is CC(=O)c1cccc(N(CC(=O)Nc2c(C)cccc2C(C)C)C(C)=O)c1.
What is the InChIKey of 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The InChIKey is RSSKJZPSKAHDIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-14(2)20-11-6-8-15(3)22(20)23-21(27)13-24(17(5)26)19-10-7-9-18(12-19)16(4)25/h6-12,14H,13H2,1-5H3,(H,23,27).
What are the key properties of 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide has a molecular weight of 366.46 g/mol, XLogP of 4.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N,3-diacetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 113175474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).