3,6-dimethylimidazo[1,5-a]pyrazine;ethane

C12H21N3 — CID 145222574

IUPAC3,6-dimethylimidazo[1,5-a]pyrazine;ethane
SMILESCC.CC.Cc1cn2c(C)ncc2cn1
InChIInChI=1S/C8H9N3.2C2H6/c1-6-5-11-7(2)10-4-8(11)3-9-6;2*1-2/h3-5H,1-2H3;2*1-2H3
InChIKeyZTXCUQPVOIYLHK-UHFFFAOYSA-N
MW207.32 g/mol
LogP3.40
Rot. Bonds

About 3,6-dimethylimidazo[1,5-a]pyrazine;ethane

3,6-dimethylimidazo[1,5-a]pyrazine;ethane (PubChem CID 145222574) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 3,6-dimethylimidazo[1,5-a]pyrazine;ethane.

Molecular Properties

Compound Name3,6-dimethylimidazo[1,5-a]pyrazine;ethane
PubChem CID145222574
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name3,6-dimethylimidazo[1,5-a]pyrazine;ethane
SMILESCC.CC.Cc1cn2c(C)ncc2cn1
InChIInChI=1S/C8H9N3.2C2H6/c1-6-5-11-7(2)10-4-8(11)3-9-6;2*1-2/h3-5H,1-2H3;2*1-2H3
InChIKeyZTXCUQPVOIYLHK-UHFFFAOYSA-N
XLogP3.40
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,6-dimethylimidazo[1,5-a]pyrazine;ethane?
The IUPAC name of 3,6-dimethylimidazo[1,5-a]pyrazine;ethane (CID 145222574) is 3,6-dimethylimidazo[1,5-a]pyrazine;ethane.
What is the SMILES notation for 3,6-dimethylimidazo[1,5-a]pyrazine;ethane?
The canonical SMILES for 3,6-dimethylimidazo[1,5-a]pyrazine;ethane is CC.CC.Cc1cn2c(C)ncc2cn1.
What is the InChIKey of 3,6-dimethylimidazo[1,5-a]pyrazine;ethane?
The InChIKey is ZTXCUQPVOIYLHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3.2C2H6/c1-6-5-11-7(2)10-4-8(11)3-9-6;2*1-2/h3-5H,1-2H3;2*1-2H3.
What are the key properties of 3,6-dimethylimidazo[1,5-a]pyrazine;ethane?
3,6-dimethylimidazo[1,5-a]pyrazine;ethane has a molecular weight of 207.32 g/mol, XLogP of 3.40, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethylimidazo[1,5-a]pyrazine;ethane is sourced from PubChem (CID 145222574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).