2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide

C18H18N2O7 — CID 8010465

IUPAC2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
SMILESCCOc1cc(C=O)ccc1OCC(=O)Nc1ccc([N+](=O)[O-])cc1OC
InChIInChI=1S/C18H18N2O7/c1-3-26-17-8-12(10-21)4-7-15(17)27-11-18(22)19-14-6-5-13(20(23)24)9-16(14)25-2/h4-10H,3,11H2,1-2H3,(H,19,22)
InChIKeyCHGPXYWNODLYQL-UHFFFAOYSA-N
MW374.35 g/mol
LogP2.83
Rot. Bonds9

About 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide

2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide (PubChem CID 8010465) has the molecular formula C18H18N2O7 and a molecular weight of 374.35 g/mol. Its IUPAC name is 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide.

Molecular Properties

Compound Name2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
PubChem CID8010465
Molecular FormulaC18H18N2O7
Molecular Weight374.35 g/mol
Exact Mass374.11
IUPAC Name2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
SMILESCCOc1cc(C=O)ccc1OCC(=O)Nc1ccc([N+](=O)[O-])cc1OC
InChIInChI=1S/C18H18N2O7/c1-3-26-17-8-12(10-21)4-7-15(17)27-11-18(22)19-14-6-5-13(20(23)24)9-16(14)25-2/h4-10H,3,11H2,1-2H3,(H,19,22)
InChIKeyCHGPXYWNODLYQL-UHFFFAOYSA-N
XLogP2.83
TPSA117.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.35
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)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

N-(2-methoxy-4-nitrophenyl)-2-(2-methoxyphenoxy)acetamide
CID 7720081
2-(2,4-dinitrophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 17359269
N-(2-ethoxy-5-formylphenyl)-2-(2-methoxyphenoxy)acetamide
CID 82156183
2-(2,4-dichlorophenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 2903084
2-(ethylamino)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 60641116
(4-ethoxy-3-methoxyphenyl)methyl-[2-(2-methoxy-4-nitroanilino)-2-oxoethyl]-methylazanium
CID 8798670
3-ethoxy-N-(2-methoxy-4-nitrophenyl)propanamide
CID 2975776
3-methoxy-4-[2-(4-nitrophenyl)-2-oxoethoxy]benzaldehyde
CID 2374279
2-(2-ethoxy-4-formylphenoxy)-N-phenylacetamide
CID 844203
N-(2,3-dimethylphenyl)-2-(2-ethoxy-4-formylphenoxy)acetamide
CID 978026
2-(2-ethoxy-4-formylphenoxy)-N-ethylacetamide
CID 2110936
2-(2-ethoxy-4-formylphenoxy)-N-(2-fluoro-5-methylphenyl)acetamide
CID 6457252

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide?
The IUPAC name of 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide (CID 8010465) is 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide.
What is the SMILES notation for 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide?
The canonical SMILES for 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide is CCOc1cc(C=O)ccc1OCC(=O)Nc1ccc([N+](=O)[O-])cc1OC.
What is the InChIKey of 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide?
The InChIKey is CHGPXYWNODLYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O7/c1-3-26-17-8-12(10-21)4-7-15(17)27-11-18(22)19-14-6-5-13(20(23)24)9-16(14)25-2/h4-10H,3,11H2,1-2H3,(H,19,22).
What are the key properties of 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide?
2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide has a molecular weight of 374.35 g/mol, XLogP of 2.83, 9 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxy-4-formylphenoxy)-N-(2-methoxy-4-nitrophenyl)acetamide is sourced from PubChem (CID 8010465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).