2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine

C12H14N4O — CID 14170093

IUPAC2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine
SMILESCc1cnc(COCc2cnc(C)cn2)cn1
InChIInChI=1S/C12H14N4O/c1-9-3-15-11(5-13-9)7-17-8-12-6-14-10(2)4-16-12/h3-6H,7-8H2,1-2H3
InChIKeyNHYGSJIDERQARK-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.60
Rot. Bonds4

About 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine

2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine (PubChem CID 14170093) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine.

Molecular Properties

Compound Name2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine
PubChem CID14170093
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine
SMILESCc1cnc(COCc2cnc(C)cn2)cn1
InChIInChI=1S/C12H14N4O/c1-9-3-15-11(5-13-9)7-17-8-12-6-14-10(2)4-16-12/h3-6H,7-8H2,1-2H3
InChIKeyNHYGSJIDERQARK-UHFFFAOYSA-N
XLogP1.60
TPSA60.79 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine?
The IUPAC name of 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine (CID 14170093) is 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine.
What is the SMILES notation for 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine?
The canonical SMILES for 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine is Cc1cnc(COCc2cnc(C)cn2)cn1.
What is the InChIKey of 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine?
The InChIKey is NHYGSJIDERQARK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-9-3-15-11(5-13-9)7-17-8-12-6-14-10(2)4-16-12/h3-6H,7-8H2,1-2H3.
What are the key properties of 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine?
2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine has a molecular weight of 230.27 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[(5-methylpyrazin-2-yl)methoxymethyl]pyrazine is sourced from PubChem (CID 14170093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).