(8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one

C13H12FN3O — CID 58179266

IUPAC(8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one
SMILESC[C@H]1NC(=O)Cn2cc(-c3ccc(F)cc3)nc21
InChIInChI=1S/C13H12FN3O/c1-8-13-16-11(6-17(13)7-12(18)15-8)9-2-4-10(14)5-3-9/h2-6,8H,7H2,1H3,(H,15,18)/t8-/m1/s1
InChIKeyGKZPRRDLJIMSDV-MRVPVSSYSA-N
MW245.26 g/mol
LogP1.88
Rot. Bonds1

About (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one

(8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one (PubChem CID 58179266) has the molecular formula C13H12FN3O and a molecular weight of 245.26 g/mol. Its IUPAC name is (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one.

Molecular Properties

Compound Name(8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one
PubChem CID58179266
Molecular FormulaC13H12FN3O
Molecular Weight245.26 g/mol
Exact Mass245.10
IUPAC Name(8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one
SMILESC[C@H]1NC(=O)Cn2cc(-c3ccc(F)cc3)nc21
InChIInChI=1S/C13H12FN3O/c1-8-13-16-11(6-17(13)7-12(18)15-8)9-2-4-10(14)5-3-9/h2-6,8H,7H2,1H3,(H,15,18)/t8-/m1/s1
InChIKeyGKZPRRDLJIMSDV-MRVPVSSYSA-N
XLogP1.88
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one?
The IUPAC name of (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one (CID 58179266) is (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one.
What is the SMILES notation for (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one?
The canonical SMILES for (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one is C[C@H]1NC(=O)Cn2cc(-c3ccc(F)cc3)nc21.
What is the InChIKey of (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one?
The InChIKey is GKZPRRDLJIMSDV-MRVPVSSYSA-N. The full InChI is InChI=1S/C13H12FN3O/c1-8-13-16-11(6-17(13)7-12(18)15-8)9-2-4-10(14)5-3-9/h2-6,8H,7H2,1H3,(H,15,18)/t8-/m1/s1.
What are the key properties of (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one?
(8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one has a molecular weight of 245.26 g/mol, XLogP of 1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8R)-2-(4-fluorophenyl)-8-methyl-7,8-dihydro-5H-imidazo[1,2-a]pyrazin-6-one is sourced from PubChem (CID 58179266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).