7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one

C13H12FN3O — CID 10014748

IUPAC7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
SMILESO=C1Cn2cncc2CN1Cc1ccc(F)cc1
InChIInChI=1S/C13H12FN3O/c14-11-3-1-10(2-4-11)6-16-7-12-5-15-9-17(12)8-13(16)18/h1-5,9H,6-8H2
InChIKeyMVDJFHIGCJKAKH-UHFFFAOYSA-N
MW245.26 g/mol
LogP1.56
Rot. Bonds2

About 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one

7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one (PubChem CID 10014748) has the molecular formula C13H12FN3O and a molecular weight of 245.26 g/mol. Its IUPAC name is 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one.

Molecular Properties

Compound Name7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
PubChem CID10014748
Molecular FormulaC13H12FN3O
Molecular Weight245.26 g/mol
Exact Mass245.10
IUPAC Name7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
SMILESO=C1Cn2cncc2CN1Cc1ccc(F)cc1
InChIInChI=1S/C13H12FN3O/c14-11-3-1-10(2-4-11)6-16-7-12-5-15-9-17(12)8-13(16)18/h1-5,9H,6-8H2
InChIKeyMVDJFHIGCJKAKH-UHFFFAOYSA-N
XLogP1.56
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
The IUPAC name of 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one (CID 10014748) is 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one.
What is the SMILES notation for 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
The canonical SMILES for 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one is O=C1Cn2cncc2CN1Cc1ccc(F)cc1.
What is the InChIKey of 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
The InChIKey is MVDJFHIGCJKAKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O/c14-11-3-1-10(2-4-11)6-16-7-12-5-15-9-17(12)8-13(16)18/h1-5,9H,6-8H2.
What are the key properties of 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one has a molecular weight of 245.26 g/mol, XLogP of 1.56, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(4-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one is sourced from PubChem (CID 10014748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).