2-methyl-3-[(E)-prop-1-enyl]pyrazine

C8H10N2 — CID 5370730

IUPAC2-methyl-3-[(E)-prop-1-enyl]pyrazine
SMILESC/C=C/c1nccnc1C
InChIInChI=1S/C8H10N2/c1-3-4-8-7(2)9-5-6-10-8/h3-6H,1-2H3/b4-3+
InChIKeyZCGRXTTWRNXLQZ-ONEGZZNKSA-N
MW134.18 g/mol
LogP1.82
Rot. Bonds1

About 2-methyl-3-[(E)-prop-1-enyl]pyrazine

2-methyl-3-[(E)-prop-1-enyl]pyrazine (PubChem CID 5370730) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 2-methyl-3-[(E)-prop-1-enyl]pyrazine.

Molecular Properties

Compound Name2-methyl-3-[(E)-prop-1-enyl]pyrazine
PubChem CID5370730
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name2-methyl-3-[(E)-prop-1-enyl]pyrazine
SMILESC/C=C/c1nccnc1C
InChIInChI=1S/C8H10N2/c1-3-4-8-7(2)9-5-6-10-8/h3-6H,1-2H3/b4-3+
InChIKeyZCGRXTTWRNXLQZ-ONEGZZNKSA-N
XLogP1.82
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Oltipraz
CID 47318
2-Methyl-5-vinylpyrazine
CID 26335
Vinylpyrazine
CID 77840
2-[(1E)-prop-1-en-1-yl]pyrazine
CID 5370825
2-Methyl-6-(1-propenyl)pyrazine
CID 5371945
2-Methyl-5-(1-propenyl)pyrazine
CID 5371946
2-Ethenyl-6-methylpyrazine
CID 518838
3,5-Dimethyl-2-(1-propenyl)pyrazine
CID 5371957
2-Ethenyl-3,5-dimethylpyrazine
CID 6429268
2-Ethenyl-3-ethyl-5-methylpyrazine
CID 6431144
2,5-Dimethyl-3-(1-propenyl)pyrazine
CID 5371955
2-Methyl-3-vinylpyrazine
CID 1514205

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[(E)-prop-1-enyl]pyrazine?
The IUPAC name of 2-methyl-3-[(E)-prop-1-enyl]pyrazine (CID 5370730) is 2-methyl-3-[(E)-prop-1-enyl]pyrazine.
What is the SMILES notation for 2-methyl-3-[(E)-prop-1-enyl]pyrazine?
The canonical SMILES for 2-methyl-3-[(E)-prop-1-enyl]pyrazine is C/C=C/c1nccnc1C.
What is the InChIKey of 2-methyl-3-[(E)-prop-1-enyl]pyrazine?
The InChIKey is ZCGRXTTWRNXLQZ-ONEGZZNKSA-N. The full InChI is InChI=1S/C8H10N2/c1-3-4-8-7(2)9-5-6-10-8/h3-6H,1-2H3/b4-3+.
What are the key properties of 2-methyl-3-[(E)-prop-1-enyl]pyrazine?
2-methyl-3-[(E)-prop-1-enyl]pyrazine has a molecular weight of 134.18 g/mol, XLogP of 1.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[(E)-prop-1-enyl]pyrazine is sourced from PubChem (CID 5370730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).