2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine

C20H24N6 — CID 58250609

IUPAC2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine
SMILESCc1nc(-c2nc(C)c(C)c(C)n2)c(C)nc1-c1nc(C)c(C)c(C)n1
InChIInChI=1S/C20H24N6/c1-9-11(3)23-19(24-12(9)4)17-15(7)22-18(16(8)21-17)20-25-13(5)10(2)14(6)26-20/h1-8H3
InChIKeyWJAIQYIKOVTBOU-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.86
Rot. Bonds2

About 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine

2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine (PubChem CID 58250609) has the molecular formula C20H24N6 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine.

Molecular Properties

Compound Name2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine
PubChem CID58250609
Molecular FormulaC20H24N6
Molecular Weight348.45 g/mol
Exact Mass348.21
IUPAC Name2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine
SMILESCc1nc(-c2nc(C)c(C)c(C)n2)c(C)nc1-c1nc(C)c(C)c(C)n1
InChIInChI=1S/C20H24N6/c1-9-11(3)23-19(24-12(9)4)17-15(7)22-18(16(8)21-17)20-25-13(5)10(2)14(6)26-20/h1-8H3
InChIKeyWJAIQYIKOVTBOU-UHFFFAOYSA-N
XLogP3.86
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine?
The IUPAC name of 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine (CID 58250609) is 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine.
What is the SMILES notation for 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine?
The canonical SMILES for 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine is Cc1nc(-c2nc(C)c(C)c(C)n2)c(C)nc1-c1nc(C)c(C)c(C)n1.
What is the InChIKey of 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine?
The InChIKey is WJAIQYIKOVTBOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6/c1-9-11(3)23-19(24-12(9)4)17-15(7)22-18(16(8)21-17)20-25-13(5)10(2)14(6)26-20/h1-8H3.
What are the key properties of 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine?
2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine has a molecular weight of 348.45 g/mol, XLogP of 3.86, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3,6-bis(4,5,6-trimethylpyrimidin-2-yl)pyrazine is sourced from PubChem (CID 58250609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).