1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine

C9H12N2 — CID 89345683

IUPAC1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine
SMILESC=C1C=NC=CN1/C(C)=C\C
InChIInChI=1S/C9H12N2/c1-4-8(2)11-6-5-10-7-9(11)3/h4-7H,3H2,1-2H3/b8-4-
InChIKeyAIXVRRCRGVLVIE-YWEYNIOJSA-N
MW148.21 g/mol
LogP2.28
Rot. Bonds1

About 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine

1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine (PubChem CID 89345683) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine.

Molecular Properties

Compound Name1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine
PubChem CID89345683
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine
SMILESC=C1C=NC=CN1/C(C)=C\C
InChIInChI=1S/C9H12N2/c1-4-8(2)11-6-5-10-7-9(11)3/h4-7H,3H2,1-2H3/b8-4-
InChIKeyAIXVRRCRGVLVIE-YWEYNIOJSA-N
XLogP2.28
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine?
The IUPAC name of 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine (CID 89345683) is 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine.
What is the SMILES notation for 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine?
The canonical SMILES for 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine is C=C1C=NC=CN1/C(C)=C\C.
What is the InChIKey of 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine?
The InChIKey is AIXVRRCRGVLVIE-YWEYNIOJSA-N. The full InChI is InChI=1S/C9H12N2/c1-4-8(2)11-6-5-10-7-9(11)3/h4-7H,3H2,1-2H3/b8-4-.
What are the key properties of 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine?
1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine has a molecular weight of 148.21 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-but-2-en-2-yl]-2-methylidenepyrazine is sourced from PubChem (CID 89345683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).