1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one

C17H18N2O2 — CID 65446883

IUPAC1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one
SMILESCOc1ccc(CCN2C(=O)CNc3ccccc32)cc1
InChIInChI=1S/C17H18N2O2/c1-21-14-8-6-13(7-9-14)10-11-19-16-5-3-2-4-15(16)18-12-17(19)20/h2-9,18H,10-12H2,1H3
InChIKeyNYCUCMKSOYDDAW-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.70
Rot. Bonds4

About 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one

1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one (PubChem CID 65446883) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one
PubChem CID65446883
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one
SMILESCOc1ccc(CCN2C(=O)CNc3ccccc32)cc1
InChIInChI=1S/C17H18N2O2/c1-21-14-8-6-13(7-9-14)10-11-19-16-5-3-2-4-15(16)18-12-17(19)20/h2-9,18H,10-12H2,1H3
InChIKeyNYCUCMKSOYDDAW-UHFFFAOYSA-N
XLogP2.70
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,4-dihydroquinoxalin-2-one
CID 104566166
1-(4-methoxyphenyl)-3,4-dihydroquinoxalin-2-one
CID 117006508
1-[(4-methoxyphenyl)methyl]-3,4-dihydro-1,4-benzodiazepine-2,5-dione
CID 3345025
1-[2-(4-tert-butylphenoxy)ethyl]-3,4-dihydroquinoxalin-2-one
CID 82156906
1-[2-(1-methylimidazol-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one
CID 114531269
7-methoxy-1-propyl-3,4-dihydroquinoxalin-2-one
CID 84623560
2-[2-(2-oxo-3,4-dihydroquinoxalin-1-yl)ethyl]isoindole-1,3-dione
CID 94763938
1-but-3-ynyl-3,4-dihydroquinoxalin-2-one
CID 63643833
4-(2-oxo-3,4-dihydroquinoxalin-1-yl)butanenitrile
CID 62876473
1-(2-piperazin-1-ylethyl)-3,4-dihydroquinoxalin-2-one
CID 117030577
(3aS)-5-[2-(4-methoxyphenyl)ethyl]-2-phenyl-3,3a-dihydro-1H-imidazo[1,5-a]quinoxalin-4-one
CID 167433621
1-(2-methylprop-2-enyl)-3,4-dihydroquinoxalin-2-one
CID 82156911

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one?
The IUPAC name of 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one (CID 65446883) is 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one.
What is the SMILES notation for 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one?
The canonical SMILES for 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one is COc1ccc(CCN2C(=O)CNc3ccccc32)cc1.
What is the InChIKey of 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one?
The InChIKey is NYCUCMKSOYDDAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-21-14-8-6-13(7-9-14)10-11-19-16-5-3-2-4-15(16)18-12-17(19)20/h2-9,18H,10-12H2,1H3.
What are the key properties of 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one?
1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one has a molecular weight of 282.34 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinoxalin-2-one is sourced from PubChem (CID 65446883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).