7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one

C11H10FN3O — CID 171520973

IUPAC7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one
SMILESC=Cc1ncc2nc(CC)c(=O)[nH]c2c1F
InChIInChI=1S/C11H10FN3O/c1-3-6-9(12)10-8(5-13-6)14-7(4-2)11(16)15-10/h3,5H,1,4H2,2H3,(H,15,16)
InChIKeyAXNBGDYNFWNLFV-UHFFFAOYSA-N
MW219.22 g/mol
LogP1.66
Rot. Bonds2

About 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one

7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one (PubChem CID 171520973) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one.

Molecular Properties

Compound Name7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one
PubChem CID171520973
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one
SMILESC=Cc1ncc2nc(CC)c(=O)[nH]c2c1F
InChIInChI=1S/C11H10FN3O/c1-3-6-9(12)10-8(5-13-6)14-7(4-2)11(16)15-10/h3,5H,1,4H2,2H3,(H,15,16)
InChIKeyAXNBGDYNFWNLFV-UHFFFAOYSA-N
XLogP1.66
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-(bromomethyl)-3-ethyl-8-fluoro-1H-quinoxalin-2-one
CID 162524420
2-ethenyl-3-ethyl-5-methylpyrazine
CID 6431144
3-ethyl-8-fluoro-4-methoxy-2-oxo-1H-1,6-naphthyridine-7-carbaldehyde
CID 171520975
ethane;3-ethyl-6-fluoro-7-(hydroxymethyl)-1H-quinoxalin-2-one
CID 168995296
5-[4-[(3-ethyl-8-fluoro-2-oxo-1H-pyrido[3,4-b]pyrazin-7-yl)methyl]piperazin-1-yl]-6-fluoro-N-pyrrolidin-1-ylpyridine-2-carboxamide
CID 178131767
5-[4-[(2-ethyl-5-fluoro-3-oxo-4H-quinoxalin-6-yl)methyl]piperazin-1-yl]pyridine-2-carboxylic acid
CID 178131889
3-ethyl-7-fluoro-6-methoxy-1H-quinoxalin-2-one
CID 90101779
4,5-bis(ethenyl)-2-ethyl-1H-pyrimidin-6-one
CID 143553883
sodium 6-[4-[(2-ethyl-5-fluoro-3-oxo-4H-quinoxalin-6-yl)methyl]piperazin-1-yl]-5-fluoropyridine-3-carboxylate
CID 178131795
6-[1-(ethenylamino)-2-methylpropyl]-3-ethyl-1H-quinoxalin-2-one
CID 143057301
7-bromo-3-ethyl-5-fluoro-1H-quinoxalin-2-one
CID 168856768
7-bromo-3-ethyl-1H-pyrido[2,3-b]pyrazin-2-one
CID 168984379

Frequently Asked Questions

What is the IUPAC name of 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one?
The IUPAC name of 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one (CID 171520973) is 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one.
What is the SMILES notation for 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one?
The canonical SMILES for 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one is C=Cc1ncc2nc(CC)c(=O)[nH]c2c1F.
What is the InChIKey of 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one?
The InChIKey is AXNBGDYNFWNLFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c1-3-6-9(12)10-8(5-13-6)14-7(4-2)11(16)15-10/h3,5H,1,4H2,2H3,(H,15,16).
What are the key properties of 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one?
7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one has a molecular weight of 219.22 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethenyl-3-ethyl-8-fluoro-1H-pyrido[3,4-b]pyrazin-2-one is sourced from PubChem (CID 171520973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).