2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide

C19H20ClNO5 — CID 28913481

IUPAC2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCCOc1cc(C=O)cc(Cl)c1OCC(=O)Nc1cc(C)ccc1OC
InChIInChI=1S/C19H20ClNO5/c1-4-25-17-9-13(10-22)8-14(20)19(17)26-11-18(23)21-15-7-12(2)5-6-16(15)24-3/h5-10H,4,11H2,1-3H3,(H,21,23)
InChIKeyKRGFFUBBBQPYEZ-UHFFFAOYSA-N
MW377.82 g/mol
LogP3.89
Rot. Bonds8

About 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide

2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide (PubChem CID 28913481) has the molecular formula C19H20ClNO5 and a molecular weight of 377.82 g/mol. Its IUPAC name is 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
PubChem CID28913481
Molecular FormulaC19H20ClNO5
Molecular Weight377.82 g/mol
Exact Mass377.10
IUPAC Name2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCCOc1cc(C=O)cc(Cl)c1OCC(=O)Nc1cc(C)ccc1OC
InChIInChI=1S/C19H20ClNO5/c1-4-25-17-9-13(10-22)8-14(20)19(17)26-11-18(23)21-15-7-12(2)5-6-16(15)24-3/h5-10H,4,11H2,1-3H3,(H,21,23)
InChIKeyKRGFFUBBBQPYEZ-UHFFFAOYSA-N
XLogP3.89
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.82
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2-chloro-4-formyl-6-methoxyphenoxy)-N-(2-ethoxyphenyl)acetamide
CID 28913373
N-(2-methoxy-5-methylphenyl)-2-(2,4,6-trichlorophenoxy)acetamide
CID 7275215
2-(2-chloro-4-formyl-6-methoxyphenoxy)-N-(3-methylphenyl)acetamide
CID 895523
2-(2-chloro-4-formyl-6-methoxyphenoxy)-N-(2,5-dichlorophenyl)acetamide
CID 28913450
N-(2,4-dimethylphenyl)-2-(4-formyl-2,6-dimethoxyphenoxy)acetamide
CID 28913315
2-[(Z)-(4-ethoxy-3-methoxyphenyl)methylideneamino]oxy-N-(2-methoxy-5-methylphenyl)acetamide
CID 7662790
2-(2-ethoxy-4-formylphenoxy)-N-(2-fluoro-5-methylphenyl)acetamide
CID 6457252
N'-[(Z)-[3-chloro-4-[2-(2,4-dimethylanilino)-2-oxoethoxy]-5-ethoxyphenyl]methylideneamino]-N-methyloxamide
CID 126158500
2-(3-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 7128211
N-(2,5-dimethylphenyl)-2-(4-formyl-2-iodo-6-methoxyphenoxy)acetamide
CID 126259987
N-[(E)-[3-chloro-5-ethoxy-4-[2-(4-methoxyanilino)-2-oxoethoxy]phenyl]methylideneamino]-4-methylbenzamide
CID 126382214
2-(2-bromo-6-ethoxy-4-formylphenoxy)-N-(2-chlorophenyl)acetamide
CID 1284879

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide (CID 28913481) is 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide is CCOc1cc(C=O)cc(Cl)c1OCC(=O)Nc1cc(C)ccc1OC.
What is the InChIKey of 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide?
The InChIKey is KRGFFUBBBQPYEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClNO5/c1-4-25-17-9-13(10-22)8-14(20)19(17)26-11-18(23)21-15-7-12(2)5-6-16(15)24-3/h5-10H,4,11H2,1-3H3,(H,21,23).
What are the key properties of 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide?
2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide has a molecular weight of 377.82 g/mol, XLogP of 3.89, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-ethoxy-4-formylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 28913481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).