4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one

C18H18N2O4 — CID 26860466

IUPAC4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one
SMILESCCOc1ccccc1OCC(=O)N1CC(=O)Nc2ccccc21
InChIInChI=1S/C18H18N2O4/c1-2-23-15-9-5-6-10-16(15)24-12-18(22)20-11-17(21)19-13-7-3-4-8-14(13)20/h3-10H,2,11-12H2,1H3,(H,19,21)
InChIKeyKBNPXMYXMUOFJO-UHFFFAOYSA-N
MW326.35 g/mol
LogP2.45
Rot. Bonds5

About 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one

4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one (PubChem CID 26860466) has the molecular formula C18H18N2O4 and a molecular weight of 326.35 g/mol. Its IUPAC name is 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one
PubChem CID26860466
Molecular FormulaC18H18N2O4
Molecular Weight326.35 g/mol
Exact Mass326.13
IUPAC Name4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one
SMILESCCOc1ccccc1OCC(=O)N1CC(=O)Nc2ccccc21
InChIInChI=1S/C18H18N2O4/c1-2-23-15-9-5-6-10-16(15)24-12-18(22)20-11-17(21)19-13-7-3-4-8-14(13)20/h3-10H,2,11-12H2,1H3,(H,19,21)
InChIKeyKBNPXMYXMUOFJO-UHFFFAOYSA-N
XLogP2.45
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethoxy]phenyl]acetamide
CID 2411041
[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 2-(2-methoxyphenoxy)acetate
CID 7854017
2-[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethoxy]benzonitrile
CID 2706735
4-[2-(2,4,6-trimethylphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one
CID 26860757
4-[2-(2-methoxy-4-prop-2-enylphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one
CID 26860602
4-[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethoxy]benzonitrile
CID 7818538
4-[2-(2-ethoxyphenoxy)acetyl]-3,3-dimethyl-1H-quinoxalin-2-one
CID 7840966
4-[2-(3-phenoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one
CID 2640660
N-[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]-4-oxo-4-(3-oxo-2,4-dihydroquinoxalin-1-yl)butanamide
CID 55895351
4-[2-(4,8-dimethyl-2-oxochromen-7-yl)oxyacetyl]-1,3-dihydroquinoxalin-2-one
CID 8563603
[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 4-methylbenzoate
CID 2506258
trans-[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] (1S,2S)-2-methylcyclopropane-1-carboxylate
CID 7776857

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one?
The IUPAC name of 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one (CID 26860466) is 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one.
What is the SMILES notation for 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one?
The canonical SMILES for 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one is CCOc1ccccc1OCC(=O)N1CC(=O)Nc2ccccc21.
What is the InChIKey of 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one?
The InChIKey is KBNPXMYXMUOFJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O4/c1-2-23-15-9-5-6-10-16(15)24-12-18(22)20-11-17(21)19-13-7-3-4-8-14(13)20/h3-10H,2,11-12H2,1H3,(H,19,21).
What are the key properties of 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one?
4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one has a molecular weight of 326.35 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-ethoxyphenoxy)acetyl]-1,3-dihydroquinoxalin-2-one is sourced from PubChem (CID 26860466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).