4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline

C16H18N2O — CID 117006758

IUPAC4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline
SMILESCCOc1ccc(N2CCNc3ccccc32)cc1
InChIInChI=1S/C16H18N2O/c1-2-19-14-9-7-13(8-10-14)18-12-11-17-15-5-3-4-6-16(15)18/h3-10,17H,2,11-12H2,1H3
InChIKeyCVEQJYZKARBPJR-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.65
Rot. Bonds3

About 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline

4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline (PubChem CID 117006758) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline
PubChem CID117006758
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline
SMILESCCOc1ccc(N2CCNc3ccccc32)cc1
InChIInChI=1S/C16H18N2O/c1-2-19-14-9-7-13(8-10-14)18-12-11-17-15-5-3-4-6-16(15)18/h3-10,17H,2,11-12H2,1H3
InChIKeyCVEQJYZKARBPJR-UHFFFAOYSA-N
XLogP3.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-2,3-dihydro-1H-quinoxaline
CID 3056887
4-(3-chlorophenyl)-2,3-dihydro-1H-quinoxaline
CID 117006745
6-(4-bromophenyl)-2,3,4,5-tetrahydro-1H-1,6-benzodiazocine
CID 117015772
benzyl 4-[4-(3,4-dihydro-2H-quinoxalin-1-yl)phenyl]piperazine-1-carboxylate
CID 66863213
4-(3-amino-5-ethoxyphenyl)-1,3-dihydroquinoxalin-2-one
CID 80726419
4-phenyl-2,3-dihydro-1H-quinoxaline-6-carbonitrile
CID 117007124
1-(4-ethoxyphenyl)imidazolidine-2,4-dione
CID 2848649
ethoxybenzene chloride
CID 21193593
3-(4-ethoxyphenyl)-1-phenyl-4-sulfanylideneimidazolidin-2-one
CID 11392810
(E)-3-(4-ethoxyphenyl)-N-[4-(2-oxoimidazolidin-1-yl)phenyl]prop-2-enamide
CID 46525062
1-(4-ethoxyphenyl)-4-methylpiperazine-2,3-dione
CID 117026421
4-(4-ethoxyphenyl)-1,4-diazepan-2-one
CID 117005292

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline (CID 117006758) is 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline is CCOc1ccc(N2CCNc3ccccc32)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline?
The InChIKey is CVEQJYZKARBPJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-2-19-14-9-7-13(8-10-14)18-12-11-17-15-5-3-4-6-16(15)18/h3-10,17H,2,11-12H2,1H3.
What are the key properties of 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline?
4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline has a molecular weight of 254.33 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 117006758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).