1-benzyl-3-ethylquinoxalin-2-one

C17H16N2O — CID 91739681

IUPAC1-benzyl-3-ethylquinoxalin-2-one
SMILESCCc1nc2ccccc2n(Cc2ccccc2)c1=O
InChIInChI=1S/C17H16N2O/c1-2-14-17(20)19(12-13-8-4-3-5-9-13)16-11-7-6-10-15(16)18-14/h3-11H,2,12H2,1H3
InChIKeyLRKVJJWTBLJGQI-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.01
Rot. Bonds3

About 1-benzyl-3-ethylquinoxalin-2-one

1-benzyl-3-ethylquinoxalin-2-one (PubChem CID 91739681) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-benzyl-3-ethylquinoxalin-2-one.

Molecular Properties

Compound Name1-benzyl-3-ethylquinoxalin-2-one
PubChem CID91739681
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name1-benzyl-3-ethylquinoxalin-2-one
SMILESCCc1nc2ccccc2n(Cc2ccccc2)c1=O
InChIInChI=1S/C17H16N2O/c1-2-14-17(20)19(12-13-8-4-3-5-9-13)16-11-7-6-10-15(16)18-14/h3-11H,2,12H2,1H3
InChIKeyLRKVJJWTBLJGQI-UHFFFAOYSA-N
XLogP3.01
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-3-methylquinoxalin-2-one
CID 139051924
1-benzyl-2-[1-(1-benzylbenzimidazol-2-yl)ethyl]benzimidazole
CID 141183373
1-benzyl-3-phenylsulfanylquinoxalin-2-one
CID 162371396
1-benzyl-3-(4-methylpiperazin-1-yl)quinoxalin-2-one
CID 67481732
3-methyl-1-[(4-methylphenyl)methyl]quinoxalin-2-one
CID 13170889
1-benzyl-3-piperidin-1-ylquinoxalin-2-one
CID 174769757
1-benzyl-3-(1-hydroxyethylamino)quinoxalin-2-one
CID 174769465
1-benzyl-2-propylbenzimidazole
CID 764560
1-benzyl-2-chlorobenzimidazole
CID 3821987
ethyl 3-[4-[(4-chlorophenyl)methyl]-3-oxoquinoxalin-2-yl]propanoate
CID 4640836
1-benzyl-2-ethylsulfanylbenzimidazole
CID 700789
(E)-1,2-bis(1-benzylbenzimidazol-2-yl)ethene-1,2-diol
CID 3113691

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-ethylquinoxalin-2-one?
The IUPAC name of 1-benzyl-3-ethylquinoxalin-2-one (CID 91739681) is 1-benzyl-3-ethylquinoxalin-2-one.
What is the SMILES notation for 1-benzyl-3-ethylquinoxalin-2-one?
The canonical SMILES for 1-benzyl-3-ethylquinoxalin-2-one is CCc1nc2ccccc2n(Cc2ccccc2)c1=O.
What is the InChIKey of 1-benzyl-3-ethylquinoxalin-2-one?
The InChIKey is LRKVJJWTBLJGQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-2-14-17(20)19(12-13-8-4-3-5-9-13)16-11-7-6-10-15(16)18-14/h3-11H,2,12H2,1H3.
What are the key properties of 1-benzyl-3-ethylquinoxalin-2-one?
1-benzyl-3-ethylquinoxalin-2-one has a molecular weight of 264.33 g/mol, XLogP of 3.01, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-ethylquinoxalin-2-one is sourced from PubChem (CID 91739681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).