(2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine

C11H14N2 — CID 146437046

IUPAC(2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine
SMILESC=c1nccn/c1=C/C(C)=C(C)C
InChIInChI=1S/C11H14N2/c1-8(2)9(3)7-11-10(4)12-5-6-13-11/h5-7H,4H2,1-3H3/b11-7+
InChIKeyWPSLZIZVZIHBFC-YRNVUSSQSA-N
MW174.25 g/mol
LogP1.02
Rot. Bonds1

About (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine

(2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine (PubChem CID 146437046) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine.

Molecular Properties

Compound Name(2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine
PubChem CID146437046
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name(2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine
SMILESC=c1nccn/c1=C/C(C)=C(C)C
InChIInChI=1S/C11H14N2/c1-8(2)9(3)7-11-10(4)12-5-6-13-11/h5-7H,4H2,1-3H3/b11-7+
InChIKeyWPSLZIZVZIHBFC-YRNVUSSQSA-N
XLogP1.02
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine?
The IUPAC name of (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine (CID 146437046) is (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine.
What is the SMILES notation for (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine?
The canonical SMILES for (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine is C=c1nccn/c1=C/C(C)=C(C)C.
What is the InChIKey of (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine?
The InChIKey is WPSLZIZVZIHBFC-YRNVUSSQSA-N. The full InChI is InChI=1S/C11H14N2/c1-8(2)9(3)7-11-10(4)12-5-6-13-11/h5-7H,4H2,1-3H3/b11-7+.
What are the key properties of (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine?
(2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine has a molecular weight of 174.25 g/mol, XLogP of 1.02, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-(2,3-dimethylbut-2-enylidene)-3-methylidenepyrazine is sourced from PubChem (CID 146437046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).