N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide

C17H19NO4 — CID 78838138

IUPACN-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide
SMILESCOc1cc(C)c(NC(=O)Cc2ccc(O)cc2)cc1OC
InChIInChI=1S/C17H19NO4/c1-11-8-15(21-2)16(22-3)10-14(11)18-17(20)9-12-4-6-13(19)7-5-12/h4-8,10,19H,9H2,1-3H3,(H,18,20)
InChIKeyUNZAIEVIWSEXRY-UHFFFAOYSA-N
MW301.34 g/mol
LogP2.90
Rot. Bonds5

About N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide

N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide (PubChem CID 78838138) has the molecular formula C17H19NO4 and a molecular weight of 301.34 g/mol. Its IUPAC name is N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide
PubChem CID78838138
Molecular FormulaC17H19NO4
Molecular Weight301.34 g/mol
Exact Mass301.13
IUPAC NameN-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide
SMILESCOc1cc(C)c(NC(=O)Cc2ccc(O)cc2)cc1OC
InChIInChI=1S/C17H19NO4/c1-11-8-15(21-2)16(22-3)10-14(11)18-17(20)9-12-4-6-13(19)7-5-12/h4-8,10,19H,9H2,1-3H3,(H,18,20)
InChIKeyUNZAIEVIWSEXRY-UHFFFAOYSA-N
XLogP2.90
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.34
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide?
The IUPAC name of N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide (CID 78838138) is N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide?
The canonical SMILES for N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide is COc1cc(C)c(NC(=O)Cc2ccc(O)cc2)cc1OC.
What is the InChIKey of N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide?
The InChIKey is UNZAIEVIWSEXRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO4/c1-11-8-15(21-2)16(22-3)10-14(11)18-17(20)9-12-4-6-13(19)7-5-12/h4-8,10,19H,9H2,1-3H3,(H,18,20).
What are the key properties of N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide?
N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide has a molecular weight of 301.34 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethoxy-2-methylphenyl)-2-(4-hydroxyphenyl)acetamide is sourced from PubChem (CID 78838138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).