1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine

C11H19N3 — CID 83637202

IUPAC1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
SMILESCc1nc(C(C)(C)C)c2n1CCNC2
InChIInChI=1S/C11H19N3/c1-8-13-10(11(2,3)4)9-7-12-5-6-14(8)9/h12H,5-7H2,1-4H3
InChIKeyOIMDDHBHTKHAQE-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.59
Rot. Bonds

About 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine

1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine (PubChem CID 83637202) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
PubChem CID83637202
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
SMILESCc1nc(C(C)(C)C)c2n1CCNC2
InChIInChI=1S/C11H19N3/c1-8-13-10(11(2,3)4)9-7-12-5-6-14(8)9/h12H,5-7H2,1-4H3
InChIKeyOIMDDHBHTKHAQE-UHFFFAOYSA-N
XLogP1.59
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The IUPAC name of 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine (CID 83637202) is 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine.
What is the SMILES notation for 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The canonical SMILES for 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine is Cc1nc(C(C)(C)C)c2n1CCNC2.
What is the InChIKey of 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The InChIKey is OIMDDHBHTKHAQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8-13-10(11(2,3)4)9-7-12-5-6-14(8)9/h12H,5-7H2,1-4H3.
What are the key properties of 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine has a molecular weight of 193.29 g/mol, XLogP of 1.59, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine is sourced from PubChem (CID 83637202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).