N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene

C32H43NO2 — CID 143822741

IUPACN-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene
SMILESCCC(=O)N(CCc1ccc(OC)cc1)C(C)c1ccc(C(C)(C)C)cc1.CCc1ccccc1
InChIInChI=1S/C24H33NO2.C8H10/c1-7-23(26)25(17-16-19-8-14-22(27-6)15-9-19)18(2)20-10-12-21(13-11-20)24(3,4)5;1-2-8-6-4-3-5-7-8/h8-15,18H,7,16-17H2,1-6H3;3-7H,2H2,1H3
InChIKeyGLVQPPLGVDIMDR-UHFFFAOYSA-N
MW473.70 g/mol
LogP7.78
Rot. Bonds8

About N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene

N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene (PubChem CID 143822741) has the molecular formula C32H43NO2 and a molecular weight of 473.70 g/mol. Its IUPAC name is N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene.

Molecular Properties

Compound NameN-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene
PubChem CID143822741
Molecular FormulaC32H43NO2
Molecular Weight473.70 g/mol
Exact Mass473.33
IUPAC NameN-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene
SMILESCCC(=O)N(CCc1ccc(OC)cc1)C(C)c1ccc(C(C)(C)C)cc1.CCc1ccccc1
InChIInChI=1S/C24H33NO2.C8H10/c1-7-23(26)25(17-16-19-8-14-22(27-6)15-9-19)18(2)20-10-12-21(13-11-20)24(3,4)5;1-2-8-6-4-3-5-7-8/h8-15,18H,7,16-17H2,1-6H3;3-7H,2H2,1H3
InChIKeyGLVQPPLGVDIMDR-UHFFFAOYSA-N
XLogP7.78
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.70
LogP ≤ 57.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene 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-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]-2,2-dimethylpropanamide
CID 143822863
1-tert-butyl-4-[1-(4-methoxyphenyl)-3-phenylpropyl]benzene
CID 168720165
1,3-bis(4-propan-2-ylphenyl)propan-1-ol;1-(4-tert-butylphenyl)-3-(4-propan-2-ylphenyl)propan-1-ol;3-(4-tert-butylphenyl)-1-(4-propan-2-ylphenyl)propan-1-ol;1,3-diphenylpropan-1-ol;1-(4-methoxyphenyl)-3-(4-propan-2-ylphenyl)propan-1-ol;3-(4-methoxyphenyl)-1-(4-propan-2-ylphenyl)propan-1-ol;1-phenyl-3-(4-propan-2-ylphenyl)propan-1-ol;3-phenyl-1-(4-propan-2-ylphenyl)propan-1-ol
CID 158011051
tert-butyl N-[(R)-deuterio(phenyl)methyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]carbamate
CID 136864069
2-[2-(4-methoxyphenyl)ethyl-methylamino]propanoic acid
CID 62638720
2-[[2-(4-methoxyphenyl)acetyl]-(2-phenylethyl)amino]-N-propylpropanamide
CID 132657500
2-[2-(4-methoxyphenyl)ethyl-methylamino]propanoic acid;hydrochloride
CID 119913768
N-tert-butyl-2-[[2-(4-methoxyphenoxy)acetyl]-(2-phenylethyl)amino]propanamide
CID 132707536
(2R)-N-[(2S)-butan-2-yl]-2-[[2-(4-methoxyphenyl)acetyl]-(2-phenylethyl)amino]propanamide
CID 100637034
(2S)-2-[[2-(4-methoxyphenyl)acetyl]-(2-phenylethyl)amino]-N-(2-methylpropyl)butanamide
CID 100514241
3-[1-phenylethyl(propanoyl)amino]propanoic acid
CID 82323265
4-amino-N-benzyl-N-[2-(4-methoxyphenyl)ethyl]pentanamide
CID 120562136

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene?
The IUPAC name of N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene (CID 143822741) is N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene.
What is the SMILES notation for N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene?
The canonical SMILES for N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene is CCC(=O)N(CCc1ccc(OC)cc1)C(C)c1ccc(C(C)(C)C)cc1.CCc1ccccc1.
What is the InChIKey of N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene?
The InChIKey is GLVQPPLGVDIMDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33NO2.C8H10/c1-7-23(26)25(17-16-19-8-14-22(27-6)15-9-19)18(2)20-10-12-21(13-11-20)24(3,4)5;1-2-8-6-4-3-5-7-8/h8-15,18H,7,16-17H2,1-6H3;3-7H,2H2,1H3.
What are the key properties of N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene?
N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene has a molecular weight of 473.70 g/mol, XLogP of 7.78, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-tert-butylphenyl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]propanamide;ethylbenzene is sourced from PubChem (CID 143822741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).