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

C14H18N4 — CID 58250619

IUPAC2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine
SMILESCc1nc(C)c(-c2nc(C)c(C)c(C)n2)nc1C
InChIInChI=1S/C14H18N4/c1-7-8(2)17-14(18-9(7)3)13-12(6)15-10(4)11(5)16-13/h1-6H3
InChIKeyOPBPOEQIPMLISX-UHFFFAOYSA-N
MW242.33 g/mol
LogP2.78
Rot. Bonds1

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

2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine (PubChem CID 58250619) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is 2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine.

Molecular Properties

Compound Name2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine
PubChem CID58250619
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine
SMILESCc1nc(C)c(-c2nc(C)c(C)c(C)n2)nc1C
InChIInChI=1S/C14H18N4/c1-7-8(2)17-14(18-9(7)3)13-12(6)15-10(4)11(5)16-13/h1-6H3
InChIKeyOPBPOEQIPMLISX-UHFFFAOYSA-N
XLogP2.78
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine?
The IUPAC name of 2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine (CID 58250619) is 2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine.
What is the SMILES notation for 2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine?
The canonical SMILES for 2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine is Cc1nc(C)c(-c2nc(C)c(C)c(C)n2)nc1C.
What is the InChIKey of 2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine?
The InChIKey is OPBPOEQIPMLISX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-7-8(2)17-14(18-9(7)3)13-12(6)15-10(4)11(5)16-13/h1-6H3.
What are the key properties of 2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine?
2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine has a molecular weight of 242.33 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)pyrazine is sourced from PubChem (CID 58250619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).