2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide

C15H19NO5 — CID 63097655

IUPAC2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide
SMILESCOc1cccc(C=O)c1OCC(=O)NC1CCOCC1
InChIInChI=1S/C15H19NO5/c1-19-13-4-2-3-11(9-17)15(13)21-10-14(18)16-12-5-7-20-8-6-12/h2-4,9,12H,5-8,10H2,1H3,(H,16,18)
InChIKeyHZOAIIREPCAYPA-UHFFFAOYSA-N
MW293.32 g/mol
LogP1.18
Rot. Bonds6

About 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide

2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide (PubChem CID 63097655) has the molecular formula C15H19NO5 and a molecular weight of 293.32 g/mol. Its IUPAC name is 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide
PubChem CID63097655
Molecular FormulaC15H19NO5
Molecular Weight293.32 g/mol
Exact Mass293.13
IUPAC Name2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide
SMILESCOc1cccc(C=O)c1OCC(=O)NC1CCOCC1
InChIInChI=1S/C15H19NO5/c1-19-13-4-2-3-11(9-17)15(13)21-10-14(18)16-12-5-7-20-8-6-12/h2-4,9,12H,5-8,10H2,1H3,(H,16,18)
InChIKeyHZOAIIREPCAYPA-UHFFFAOYSA-N
XLogP1.18
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide 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

2-(2-formyl-6-methoxyphenoxy)-N-methylacetamide
CID 43471368
N-cyclopropyl-2-(2,3-dimethoxyphenoxy)acetamide
CID 112978329
2-(2-formyl-6-methoxyphenoxy)acetic acid
CID 737589
N-cyclohexyl-2-(2-fluoro-6-formylphenoxy)acetamide
CID 115955712
2-(2-formyl-6-methoxyphenoxy)acetate
CID 6933847
[2-(cyclopropylamino)-2-oxoethyl] (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate
CID 2365056
2-(2-amino-3-hydroxyphenoxy)-N-(oxan-4-yl)acetamide
CID 114764389
2-(2-formyl-6-methoxyphenoxy)-N-pentan-2-ylacetamide
CID 61489932
N-cyclopropyl-2-[2-methoxy-6-(propylaminomethyl)phenoxy]acetamide
CID 43472022
N-(oxan-4-yl)-2-phenoxyacetamide
CID 61062946
N-(4-ethoxyphenyl)-2-(2-formyl-6-methoxyphenoxy)acetamide
CID 17201773
2-(2-methoxyphenoxy)-N-piperidin-4-ylacetamide
CID 28810945

Frequently Asked Questions

What is the IUPAC name of 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide?
The IUPAC name of 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide (CID 63097655) is 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide?
The canonical SMILES for 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide is COc1cccc(C=O)c1OCC(=O)NC1CCOCC1.
What is the InChIKey of 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide?
The InChIKey is HZOAIIREPCAYPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO5/c1-19-13-4-2-3-11(9-17)15(13)21-10-14(18)16-12-5-7-20-8-6-12/h2-4,9,12H,5-8,10H2,1H3,(H,16,18).
What are the key properties of 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide?
2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide has a molecular weight of 293.32 g/mol, XLogP of 1.18, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-formyl-6-methoxyphenoxy)-N-(oxan-4-yl)acetamide is sourced from PubChem (CID 63097655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).