2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide

C13H19NO3 — CID 115140443

IUPAC2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide
SMILESCOc1cc(C)c(NC(=O)C(C)O)c(C)c1C
InChIInChI=1S/C13H19NO3/c1-7-6-11(17-5)8(2)9(3)12(7)14-13(16)10(4)15/h6,10,15H,1-5H3,(H,14,16)
InChIKeyVKIZBTNBISFJDO-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.94
Rot. Bonds3

About 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide

2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide (PubChem CID 115140443) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide.

Molecular Properties

Compound Name2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide
PubChem CID115140443
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide
SMILESCOc1cc(C)c(NC(=O)C(C)O)c(C)c1C
InChIInChI=1S/C13H19NO3/c1-7-6-11(17-5)8(2)9(3)12(7)14-13(16)10(4)15/h6,10,15H,1-5H3,(H,14,16)
InChIKeyVKIZBTNBISFJDO-UHFFFAOYSA-N
XLogP1.94
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide 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-(4-methoxy-2,3,6-trimethylanilino)-3-oxopropanoic acid
CID 115163267
2-hydroxy-N-(2,3,5,6-tetramethylphenyl)propanamide
CID 115140366
N-(5-chloro-4-methoxy-2-methylphenyl)-2-hydroxypropanamide
CID 115140378
N-(4-methoxy-2,3,6-trimethylphenyl)-N'-propan-2-ylethane-1,2-diamine
CID 115206306
3-amino-N-(4-methoxy-2,3,6-trimethylphenyl)cyclobutane-1-carboxamide
CID 115161356
2-amino-N-(3-chloro-6-methoxy-2,4-dimethylphenyl)propanamide
CID 115152223
(4-methoxy-2,3,6-trimethylanilino)methanethiol
CID 115227686
N'-(4-methoxy-2,3,6-trimethylphenyl)methanediamine
CID 115225481
N-(3-bromo-4-methoxy-2,6-dimethylphenyl)acetamide
CID 155615406
2-hydroxy-N-(2,4,5-trimethylphenyl)propanamide
CID 115140395
(2S)-2-amino-N-(4-bromo-2-methoxy-6-methylphenyl)propanamide
CID 61147133
4-(4-methoxy-2,3,6-trimethylanilino)butan-1-ol
CID 115217429

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide?
The IUPAC name of 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide (CID 115140443) is 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide.
What is the SMILES notation for 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide?
The canonical SMILES for 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide is COc1cc(C)c(NC(=O)C(C)O)c(C)c1C.
What is the InChIKey of 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide?
The InChIKey is VKIZBTNBISFJDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-7-6-11(17-5)8(2)9(3)12(7)14-13(16)10(4)15/h6,10,15H,1-5H3,(H,14,16).
What are the key properties of 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide?
2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide has a molecular weight of 237.30 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)propanamide is sourced from PubChem (CID 115140443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).