6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one

C15H21N3O2 — CID 122652455

IUPAC6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one
SMILESCCCn1c(C)cn2c(C3CCOCC3)ncc2c1=O
InChIInChI=1S/C15H21N3O2/c1-3-6-17-11(2)10-18-13(15(17)19)9-16-14(18)12-4-7-20-8-5-12/h9-10,12H,3-8H2,1-2H3
InChIKeyARICWMJJQKCTDR-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.11
Rot. Bonds3

About 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one

6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one (PubChem CID 122652455) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one.

Molecular Properties

Compound Name6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one
PubChem CID122652455
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one
SMILESCCCn1c(C)cn2c(C3CCOCC3)ncc2c1=O
InChIInChI=1S/C15H21N3O2/c1-3-6-17-11(2)10-18-13(15(17)19)9-16-14(18)12-4-7-20-8-5-12/h9-10,12H,3-8H2,1-2H3
InChIKeyARICWMJJQKCTDR-UHFFFAOYSA-N
XLogP2.11
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one?
The IUPAC name of 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one (CID 122652455) is 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one.
What is the SMILES notation for 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one?
The canonical SMILES for 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one is CCCn1c(C)cn2c(C3CCOCC3)ncc2c1=O.
What is the InChIKey of 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one?
The InChIKey is ARICWMJJQKCTDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-3-6-17-11(2)10-18-13(15(17)19)9-16-14(18)12-4-7-20-8-5-12/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one?
6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one has a molecular weight of 275.35 g/mol, XLogP of 2.11, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(oxan-4-yl)-7-propylimidazo[1,5-a]pyrazin-8-one is sourced from PubChem (CID 122652455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).