3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine

C13H19N3 — CID 170124066

IUPAC3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine
SMILESCCC(C)(CC)c1nc(C)n2ccncc12
InChIInChI=1S/C13H19N3/c1-5-13(4,6-2)12-11-9-14-7-8-16(11)10(3)15-12/h7-9H,5-6H2,1-4H3
InChIKeyJVCLUZMDIOKUKX-UHFFFAOYSA-N
MW217.32 g/mol
LogP3.12
Rot. Bonds3

About 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine

3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine (PubChem CID 170124066) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine
PubChem CID170124066
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine
SMILESCCC(C)(CC)c1nc(C)n2ccncc12
InChIInChI=1S/C13H19N3/c1-5-13(4,6-2)12-11-9-14-7-8-16(11)10(3)15-12/h7-9H,5-6H2,1-4H3
InChIKeyJVCLUZMDIOKUKX-UHFFFAOYSA-N
XLogP3.12
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine?
The IUPAC name of 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine (CID 170124066) is 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine.
What is the SMILES notation for 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine?
The canonical SMILES for 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine is CCC(C)(CC)c1nc(C)n2ccncc12.
What is the InChIKey of 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine?
The InChIKey is JVCLUZMDIOKUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-5-13(4,6-2)12-11-9-14-7-8-16(11)10(3)15-12/h7-9H,5-6H2,1-4H3.
What are the key properties of 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine?
3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine has a molecular weight of 217.32 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(3-methylpentan-3-yl)imidazo[1,5-a]pyrazine is sourced from PubChem (CID 170124066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).