6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine

C12H15N3O — CID 172745522

IUPAC6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine
SMILESCc1cn2c(C3CCOCC3)ncc2cn1
InChIInChI=1S/C12H15N3O/c1-9-8-15-11(6-13-9)7-14-12(15)10-2-4-16-5-3-10/h6-8,10H,2-5H2,1H3
InChIKeyJQZPMXIJDFNTEE-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.93
Rot. Bonds1

About 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine

6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine (PubChem CID 172745522) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine
PubChem CID172745522
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine
SMILESCc1cn2c(C3CCOCC3)ncc2cn1
InChIInChI=1S/C12H15N3O/c1-9-8-15-11(6-13-9)7-14-12(15)10-2-4-16-5-3-10/h6-8,10H,2-5H2,1H3
InChIKeyJQZPMXIJDFNTEE-UHFFFAOYSA-N
XLogP1.93
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine?
The IUPAC name of 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine (CID 172745522) is 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine.
What is the SMILES notation for 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine?
The canonical SMILES for 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine is Cc1cn2c(C3CCOCC3)ncc2cn1.
What is the InChIKey of 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine?
The InChIKey is JQZPMXIJDFNTEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-9-8-15-11(6-13-9)7-14-12(15)10-2-4-16-5-3-10/h6-8,10H,2-5H2,1H3.
What are the key properties of 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine?
6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine has a molecular weight of 217.27 g/mol, XLogP of 1.93, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazine is sourced from PubChem (CID 172745522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).