N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide

C20H19NO4 — CID 41180282

IUPACN-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide
SMILESCCOc1ccccc1NC(=O)Cc1cc(=O)oc2cc(C)ccc12
InChIInChI=1S/C20H19NO4/c1-3-24-17-7-5-4-6-16(17)21-19(22)11-14-12-20(23)25-18-10-13(2)8-9-15(14)18/h4-10,12H,3,11H2,1-2H3,(H,21,22)
InChIKeyJAJILHQIRAGFDT-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.68
Rot. Bonds5

About N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide

N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide (PubChem CID 41180282) has the molecular formula C20H19NO4 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide
PubChem CID41180282
Molecular FormulaC20H19NO4
Molecular Weight337.38 g/mol
Exact Mass337.13
IUPAC NameN-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide
SMILESCCOc1ccccc1NC(=O)Cc1cc(=O)oc2cc(C)ccc12
InChIInChI=1S/C20H19NO4/c1-3-24-17-7-5-4-6-16(17)21-19(22)11-14-12-20(23)25-18-10-13(2)8-9-15(14)18/h4-10,12H,3,11H2,1-2H3,(H,21,22)
InChIKeyJAJILHQIRAGFDT-UHFFFAOYSA-N
XLogP3.68
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-ethoxyphenyl)-2-(4-methyl-2-oxochromen-7-yl)oxyacetamide
CID 7935078
(7-methyl-2-oxochromen-4-yl)methyl 2-(2-ethoxyphenoxy)acetate
CID 7844520
(7-methyl-2-oxochromen-4-yl)methyl 3-(2-ethoxyphenyl)propanoate
CID 7524489
4-ethoxy-7-methylchromen-2-one
CID 688944
N-(2-methoxyphenyl)-2-(6-methyl-1-benzofuran-3-yl)acetamide
CID 2599354
N-(2-methyl-5-methylsulfonylphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide
CID 171909711
2-(7-methyl-2-oxochromen-4-yl)-N-propan-2-ylacetamide
CID 40805355
N-(3-acetylphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide
CID 41180290
[2-(2-ethoxyanilino)-2-oxoethyl] 6-methyl-4-oxochromene-2-carboxylate
CID 8728814
2-(7-methyl-2-oxochromen-4-yl)-N-(2-phenylethyl)acetamide
CID 41180238
N'-[2-(2-ethoxyphenoxy)acetyl]-2-(6-methyl-1-benzofuran-3-yl)acetohydrazide
CID 18159262
2-(7-methyl-2-oxochromen-4-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide
CID 41126634

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide (CID 41180282) is N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide is CCOc1ccccc1NC(=O)Cc1cc(=O)oc2cc(C)ccc12.
What is the InChIKey of N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide?
The InChIKey is JAJILHQIRAGFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO4/c1-3-24-17-7-5-4-6-16(17)21-19(22)11-14-12-20(23)25-18-10-13(2)8-9-15(14)18/h4-10,12H,3,11H2,1-2H3,(H,21,22).
What are the key properties of N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide?
N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide has a molecular weight of 337.38 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-(7-methyl-2-oxochromen-4-yl)acetamide is sourced from PubChem (CID 41180282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).