3-ethyl-3H-quinoxalin-2-one

C10H10N2O — CID 76845291

IUPAC3-ethyl-3H-quinoxalin-2-one
SMILESCCC1N=c2ccccc2=NC1=O
InChIInChI=1S/C10H10N2O/c1-2-7-10(13)12-9-6-4-3-5-8(9)11-7/h3-7H,2H2,1H3
InChIKeyGZCZZBAULMBUQN-UHFFFAOYSA-N
MW174.20 g/mol
LogP0.24
Rot. Bonds1

About 3-ethyl-3H-quinoxalin-2-one

3-ethyl-3H-quinoxalin-2-one (PubChem CID 76845291) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3-ethyl-3H-quinoxalin-2-one.

Molecular Properties

Compound Name3-ethyl-3H-quinoxalin-2-one
PubChem CID76845291
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3-ethyl-3H-quinoxalin-2-one
SMILESCCC1N=c2ccccc2=NC1=O
InChIInChI=1S/C10H10N2O/c1-2-7-10(13)12-9-6-4-3-5-8(9)11-7/h3-7H,2H2,1H3
InChIKeyGZCZZBAULMBUQN-UHFFFAOYSA-N
XLogP0.24
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Oxochinoxalin
CID 57169914
(3S)-3-methyl-3H-quinoxalin-2-one
CID 119057459
(2R)-2-methyl-2,3-dihydro-1,5-benzodiazepin-4-one
CID 121232372
6-fluoro-3H-quinoxalin-2-one
CID 71773273
3-(trifluoromethyl)-3H-quinoxalin-2-one
CID 138059371
7-bromo-3-ethyl-8-fluoro-3H-quinoxalin-2-one
CID 178188722
3-butyl-3H-quinoxalin-2-one
CID 67785876
3-[1-(diethylamino)ethyl]-3H-quinoxalin-2-one
CID 68851058
3-[2-(diethylamino)ethyl]-3H-quinoxalin-2-one
CID 69326761
8aH-1,7-naphthyridin-8-one
CID 72211740
3-oxo-2H-quinoxaline-2-carbonitrile
CID 73176674
3-methyl-3H-quinoxalin-2-one
CID 90761700

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3H-quinoxalin-2-one?
The IUPAC name of 3-ethyl-3H-quinoxalin-2-one (CID 76845291) is 3-ethyl-3H-quinoxalin-2-one.
What is the SMILES notation for 3-ethyl-3H-quinoxalin-2-one?
The canonical SMILES for 3-ethyl-3H-quinoxalin-2-one is CCC1N=c2ccccc2=NC1=O.
What is the InChIKey of 3-ethyl-3H-quinoxalin-2-one?
The InChIKey is GZCZZBAULMBUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-2-7-10(13)12-9-6-4-3-5-8(9)11-7/h3-7H,2H2,1H3.
What are the key properties of 3-ethyl-3H-quinoxalin-2-one?
3-ethyl-3H-quinoxalin-2-one has a molecular weight of 174.20 g/mol, XLogP of 0.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3H-quinoxalin-2-one is sourced from PubChem (CID 76845291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).