3-ethenyl-4-methyl-1H-pyrazine

C7H10N2 — CID 170085992

IUPAC3-ethenyl-4-methyl-1H-pyrazine
SMILESC=CC1=CNC=CN1C
InChIInChI=1S/C7H10N2/c1-3-7-6-8-4-5-9(7)2/h3-6,8H,1H2,2H3
InChIKeyKEHUNUGIABNZQT-UHFFFAOYSA-N
MW122.17 g/mol
LogP1.02
Rot. Bonds1

About 3-ethenyl-4-methyl-1H-pyrazine

3-ethenyl-4-methyl-1H-pyrazine (PubChem CID 170085992) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 3-ethenyl-4-methyl-1H-pyrazine.

Molecular Properties

Compound Name3-ethenyl-4-methyl-1H-pyrazine
PubChem CID170085992
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name3-ethenyl-4-methyl-1H-pyrazine
SMILESC=CC1=CNC=CN1C
InChIInChI=1S/C7H10N2/c1-3-7-6-8-4-5-9(7)2/h3-6,8H,1H2,2H3
InChIKeyKEHUNUGIABNZQT-UHFFFAOYSA-N
XLogP1.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-4-methyl-1H-pyrazine?
The IUPAC name of 3-ethenyl-4-methyl-1H-pyrazine (CID 170085992) is 3-ethenyl-4-methyl-1H-pyrazine.
What is the SMILES notation for 3-ethenyl-4-methyl-1H-pyrazine?
The canonical SMILES for 3-ethenyl-4-methyl-1H-pyrazine is C=CC1=CNC=CN1C.
What is the InChIKey of 3-ethenyl-4-methyl-1H-pyrazine?
The InChIKey is KEHUNUGIABNZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-3-7-6-8-4-5-9(7)2/h3-6,8H,1H2,2H3.
What are the key properties of 3-ethenyl-4-methyl-1H-pyrazine?
3-ethenyl-4-methyl-1H-pyrazine has a molecular weight of 122.17 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-4-methyl-1H-pyrazine is sourced from PubChem (CID 170085992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).