3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide

C19H23NO4 — CID 84575925

IUPAC3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide
SMILESCOc1ccc(CC(C)C(=O)Nc2ccc(O)cc2C)cc1OC
InChIInChI=1S/C19H23NO4/c1-12-10-15(21)6-7-16(12)20-19(22)13(2)9-14-5-8-17(23-3)18(11-14)24-4/h5-8,10-11,13,21H,9H2,1-4H3,(H,20,22)
InChIKeyVZWJQKLLJLKDSL-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.54
Rot. Bonds6

About 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide

3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide (PubChem CID 84575925) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide
PubChem CID84575925
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide
SMILESCOc1ccc(CC(C)C(=O)Nc2ccc(O)cc2C)cc1OC
InChIInChI=1S/C19H23NO4/c1-12-10-15(21)6-7-16(12)20-19(22)13(2)9-14-5-8-17(23-3)18(11-14)24-4/h5-8,10-11,13,21H,9H2,1-4H3,(H,20,22)
InChIKeyVZWJQKLLJLKDSL-UHFFFAOYSA-N
XLogP3.54
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide 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

3-(3,4-dihydroxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide
CID 84578793
3-(3,4-dimethoxyphenyl)-2-methyl-N-(2-methyl-1H-indol-3-yl)propanamide
CID 112527043
3-(3,4-dihydroxyphenyl)-N-[(3,4-dimethoxyphenyl)methyl]-2-methylpropanamide
CID 112522401
3-(3,4-dimethoxyphenyl)-2-methyl-N-(1,3-thiazol-2-yl)propanamide
CID 110476504
5-amino-N-(4-hydroxy-2-methylphenyl)-2-methylpentanamide
CID 104685172
1-(3,4-dimethoxyphenyl)-2-methylpentan-3-one
CID 79019340
(2S)-2-amino-N-(4-hydroxy-2-methylphenyl)-3-phenylpropanamide
CID 78995809
N-[(3,4-dimethoxyphenyl)methyl]-2-methyl-3-phenylpropanamide
CID 110355750
3-(3,4-dimethoxyphenyl)-N-(1,2-dimethylbenzimidazol-5-yl)-2-methylpropanamide
CID 112527531
N-(2,4-dimethoxyphenyl)-3-(4-fluorophenyl)-2-methylpropanamide
CID 48846730
3-(3,4-dimethoxyphenyl)-2-methyl-N-[(4-methylsulfonylphenyl)methyl]propanamide
CID 112522253
N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide
CID 78838138

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide?
The IUPAC name of 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide (CID 84575925) is 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide is COc1ccc(CC(C)C(=O)Nc2ccc(O)cc2C)cc1OC.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide?
The InChIKey is VZWJQKLLJLKDSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-12-10-15(21)6-7-16(12)20-19(22)13(2)9-14-5-8-17(23-3)18(11-14)24-4/h5-8,10-11,13,21H,9H2,1-4H3,(H,20,22).
What are the key properties of 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide?
3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide has a molecular weight of 329.40 g/mol, XLogP of 3.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)-N-(4-hydroxy-2-methylphenyl)-2-methylpropanamide is sourced from PubChem (CID 84575925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).