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

C14H19N3O2 — CID 122652457

IUPAC7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one
SMILESCCn1c(C)cn2c(C3CCOCC3)ncc2c1=O
InChIInChI=1S/C14H19N3O2/c1-3-16-10(2)9-17-12(14(16)18)8-15-13(17)11-4-6-19-7-5-11/h8-9,11H,3-7H2,1-2H3
InChIKeyWESIRYTURBTMCP-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.72
Rot. Bonds2

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

7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one (PubChem CID 122652457) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one.

Molecular Properties

Compound Name7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one
PubChem CID122652457
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one
SMILESCCn1c(C)cn2c(C3CCOCC3)ncc2c1=O
InChIInChI=1S/C14H19N3O2/c1-3-16-10(2)9-17-12(14(16)18)8-15-13(17)11-4-6-19-7-5-11/h8-9,11H,3-7H2,1-2H3
InChIKeyWESIRYTURBTMCP-UHFFFAOYSA-N
XLogP1.72
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one?
The IUPAC name of 7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one (CID 122652457) is 7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one.
What is the SMILES notation for 7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one?
The canonical SMILES for 7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one is CCn1c(C)cn2c(C3CCOCC3)ncc2c1=O.
What is the InChIKey of 7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one?
The InChIKey is WESIRYTURBTMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-3-16-10(2)9-17-12(14(16)18)8-15-13(17)11-4-6-19-7-5-11/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one?
7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one has a molecular weight of 261.32 g/mol, XLogP of 1.72, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one is sourced from PubChem (CID 122652457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).