2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide

C17H17NO4 — CID 7128211

IUPAC2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)COc1cccc(C=O)c1
InChIInChI=1S/C17H17NO4/c1-12-6-7-16(21-2)15(8-12)18-17(20)11-22-14-5-3-4-13(9-14)10-19/h3-10H,11H2,1-2H3,(H,18,20)
InChIKeyLBVJZSLTAAMXLR-UHFFFAOYSA-N
MW299.33 g/mol
LogP2.83
Rot. Bonds6

About 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide

2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide (PubChem CID 7128211) has the molecular formula C17H17NO4 and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
PubChem CID7128211
Molecular FormulaC17H17NO4
Molecular Weight299.33 g/mol
Exact Mass299.12
IUPAC Name2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)COc1cccc(C=O)c1
InChIInChI=1S/C17H17NO4/c1-12-6-7-16(21-2)15(8-12)18-17(20)11-22-14-5-3-4-13(9-14)10-19/h3-10H,11H2,1-2H3,(H,18,20)
InChIKeyLBVJZSLTAAMXLR-UHFFFAOYSA-N
XLogP2.83
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxy-5-methylphenyl)-2-(3-phenoxyphenoxy)acetamide
CID 2108595
2-(3,5-dimethoxyphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 7707192
N-(2-ethoxy-5-formylphenyl)-2-(3-methoxyphenoxy)acetamide
CID 82156185
N-(2,5-dimethoxyphenyl)-2-(3-methoxyphenoxy)acetamide
CID 19204029
2-[4-(aminomethyl)phenoxy]-N-(2-methoxy-5-methylphenyl)acetamide
CID 43822965
N-(5-formyl-2-methoxyphenyl)-2-(2-methoxyphenoxy)acetamide
CID 94762984
N'-[(Z)-[3-[2-(2,5-dimethylanilino)-2-oxoethoxy]phenyl]methylideneamino]-N-(2-methoxyphenyl)oxamide
CID 126158720
2-(2,5-dimethylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 807483
2-[3-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-(2-methoxy-5-methylphenyl)acetamide
CID 28857238
N-(4,5-dimethoxy-2-methylphenyl)-2-(3-methylphenoxy)acetamide
CID 26209437
[2-(2-methoxy-5-methylanilino)-2-oxoethyl] 4-(3-methylphenoxy)butanoate
CID 7148116
(E)-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-3-(3-methoxyphenyl)prop-2-enamide
CID 46551428

Frequently Asked Questions

What is the IUPAC name of 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide (CID 7128211) is 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide is COc1ccc(C)cc1NC(=O)COc1cccc(C=O)c1.
What is the InChIKey of 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide?
The InChIKey is LBVJZSLTAAMXLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO4/c1-12-6-7-16(21-2)15(8-12)18-17(20)11-22-14-5-3-4-13(9-14)10-19/h3-10H,11H2,1-2H3,(H,18,20).
What are the key properties of 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide?
2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide has a molecular weight of 299.33 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 7128211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).