1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one

C11H8FN3O — CID 140974798

IUPAC1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one
SMILESO=c1[nH]c2ccccc2n2c(CF)cnc12
InChIInChI=1S/C11H8FN3O/c12-5-7-6-13-10-11(16)14-8-3-1-2-4-9(8)15(7)10/h1-4,6H,5H2,(H,14,16)
InChIKeyYHDBFMKNHLIKRQ-UHFFFAOYSA-N
MW217.20 g/mol
LogP1.65
Rot. Bonds1

About 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one

1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one (PubChem CID 140974798) has the molecular formula C11H8FN3O and a molecular weight of 217.20 g/mol. Its IUPAC name is 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one.

Molecular Properties

Compound Name1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one
PubChem CID140974798
Molecular FormulaC11H8FN3O
Molecular Weight217.20 g/mol
Exact Mass217.07
IUPAC Name1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one
SMILESO=c1[nH]c2ccccc2n2c(CF)cnc12
InChIInChI=1S/C11H8FN3O/c12-5-7-6-13-10-11(16)14-8-3-1-2-4-9(8)15(7)10/h1-4,6H,5H2,(H,14,16)
InChIKeyYHDBFMKNHLIKRQ-UHFFFAOYSA-N
XLogP1.65
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.20
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one?
The IUPAC name of 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one (CID 140974798) is 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one.
What is the SMILES notation for 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one?
The canonical SMILES for 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one is O=c1[nH]c2ccccc2n2c(CF)cnc12.
What is the InChIKey of 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one?
The InChIKey is YHDBFMKNHLIKRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN3O/c12-5-7-6-13-10-11(16)14-8-3-1-2-4-9(8)15(7)10/h1-4,6H,5H2,(H,14,16).
What are the key properties of 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one?
1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one has a molecular weight of 217.20 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(fluoromethyl)-5H-imidazo[1,2-a]quinoxalin-4-one is sourced from PubChem (CID 140974798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).