3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one

C11H14FN3O — CID 139558304

IUPAC3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
SMILESO=C1Cn2c(cnc2C2CC2)CN1CCF
InChIInChI=1S/C11H14FN3O/c12-3-4-14-6-9-5-13-11(8-1-2-8)15(9)7-10(14)16/h5,8H,1-4,6-7H2
InChIKeySKMHXQZAVDMRED-UHFFFAOYSA-N
MW223.25 g/mol
LogP1.07
Rot. Bonds3

About 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one

3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one (PubChem CID 139558304) has the molecular formula C11H14FN3O and a molecular weight of 223.25 g/mol. Its IUPAC name is 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one.

Molecular Properties

Compound Name3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
PubChem CID139558304
Molecular FormulaC11H14FN3O
Molecular Weight223.25 g/mol
Exact Mass223.11
IUPAC Name3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
SMILESO=C1Cn2c(cnc2C2CC2)CN1CCF
InChIInChI=1S/C11H14FN3O/c12-3-4-14-6-9-5-13-11(8-1-2-8)15(9)7-10(14)16/h5,8H,1-4,6-7H2
InChIKeySKMHXQZAVDMRED-UHFFFAOYSA-N
XLogP1.07
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
The IUPAC name of 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one (CID 139558304) is 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one.
What is the SMILES notation for 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
The canonical SMILES for 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one is O=C1Cn2c(cnc2C2CC2)CN1CCF.
What is the InChIKey of 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
The InChIKey is SKMHXQZAVDMRED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3O/c12-3-4-14-6-9-5-13-11(8-1-2-8)15(9)7-10(14)16/h5,8H,1-4,6-7H2.
What are the key properties of 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one has a molecular weight of 223.25 g/mol, XLogP of 1.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-7-(2-fluoroethyl)-5,8-dihydroimidazo[1,5-a]pyrazin-6-one is sourced from PubChem (CID 139558304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).