2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine

C16H22N4O — CID 56599739

IUPAC2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine
SMILESCc1nc(C)c(COCc2nc(C)c(C)nc2C)nc1C
InChIInChI=1S/C16H22N4O/c1-9-11(3)19-15(13(5)17-9)7-21-8-16-14(6)18-10(2)12(4)20-16/h7-8H2,1-6H3
InChIKeyUNWPDHIQCWCSDG-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.83
Rot. Bonds4

About 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine

2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine (PubChem CID 56599739) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine.

Molecular Properties

Compound Name2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine
PubChem CID56599739
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC Name2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine
SMILESCc1nc(C)c(COCc2nc(C)c(C)nc2C)nc1C
InChIInChI=1S/C16H22N4O/c1-9-11(3)19-15(13(5)17-9)7-21-8-16-14(6)18-10(2)12(4)20-16/h7-8H2,1-6H3
InChIKeyUNWPDHIQCWCSDG-UHFFFAOYSA-N
XLogP2.83
TPSA60.79 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine?
The IUPAC name of 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine (CID 56599739) is 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine.
What is the SMILES notation for 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine?
The canonical SMILES for 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine is Cc1nc(C)c(COCc2nc(C)c(C)nc2C)nc1C.
What is the InChIKey of 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine?
The InChIKey is UNWPDHIQCWCSDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-9-11(3)19-15(13(5)17-9)7-21-8-16-14(6)18-10(2)12(4)20-16/h7-8H2,1-6H3.
What are the key properties of 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine?
2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine has a molecular weight of 286.38 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethyl-6-[(3,5,6-trimethylpyrazin-2-yl)methoxymethyl]pyrazine is sourced from PubChem (CID 56599739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).