N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide

C21H27NO2 — CID 7913902

IUPACN-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide
SMILESCc1cc(C)c(OCC(=O)Nc2ccc(C(C)(C)C)cc2)c(C)c1
InChIInChI=1S/C21H27NO2/c1-14-11-15(2)20(16(3)12-14)24-13-19(23)22-18-9-7-17(8-10-18)21(4,5)6/h7-12H,13H2,1-6H3,(H,22,23)
InChIKeyMUQDARZOEOUEJD-UHFFFAOYSA-N
MW325.45 g/mol
LogP4.93
Rot. Bonds4

About N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide

N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide (PubChem CID 7913902) has the molecular formula C21H27NO2 and a molecular weight of 325.45 g/mol. Its IUPAC name is N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide
PubChem CID7913902
Molecular FormulaC21H27NO2
Molecular Weight325.45 g/mol
Exact Mass325.20
IUPAC NameN-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide
SMILESCc1cc(C)c(OCC(=O)Nc2ccc(C(C)(C)C)cc2)c(C)c1
InChIInChI=1S/C21H27NO2/c1-14-11-15(2)20(16(3)12-14)24-13-19(23)22-18-9-7-17(8-10-18)21(4,5)6/h7-12H,13H2,1-6H3,(H,22,23)
InChIKeyMUQDARZOEOUEJD-UHFFFAOYSA-N
XLogP4.93
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.45
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)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

N-(4-methoxyphenyl)-2-(2,4,6-trimethylphenoxy)acetamide
CID 877304
N-[4-(dimethylamino)phenyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 112978164
3-[4-[[2-(2,4,6-trimethylphenoxy)acetyl]amino]phenyl]propanoic acid
CID 119252301
2-(4-tert-butylphenoxy)-N-(2,4,6-trimethylphenyl)acetamide
CID 720094
[2-[4-(methylcarbamoyl)anilino]-2-oxoethyl] 2-(2,4,6-trimethylphenoxy)acetate
CID 9405454
4-tert-butyl-N-[4-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]benzamide
CID 17235006
2-(2-amino-4,6-dimethylphenoxy)-N-phenylacetamide
CID 62056347
N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide
CID 675140
N-(4-tert-butylphenyl)-2-(2-ethoxyphenoxy)acetamide
CID 7914312
N-(4-acetamidophenyl)-2-(2,4-dimethyl-6-nitrophenoxy)acetamide
CID 23989229
2-(4-amino-2,6-dimethylphenoxy)-N-(4-fluorophenyl)acetamide
CID 63692768
4-tert-butyl-N-[3-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]phenyl]benzamide
CID 46763392

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide?
The IUPAC name of N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide (CID 7913902) is N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide.
What is the SMILES notation for N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide?
The canonical SMILES for N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide is Cc1cc(C)c(OCC(=O)Nc2ccc(C(C)(C)C)cc2)c(C)c1.
What is the InChIKey of N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide?
The InChIKey is MUQDARZOEOUEJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO2/c1-14-11-15(2)20(16(3)12-14)24-13-19(23)22-18-9-7-17(8-10-18)21(4,5)6/h7-12H,13H2,1-6H3,(H,22,23).
What are the key properties of N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide?
N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide has a molecular weight of 325.45 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylphenyl)-2-(2,4,6-trimethylphenoxy)acetamide is sourced from PubChem (CID 7913902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).