(2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine

C9H10N2 — CID 126703453

IUPAC(2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine
SMILESC=C/C=c1/nccn/c1=C/C
InChIInChI=1S/C9H10N2/c1-3-5-9-8(4-2)10-6-7-11-9/h3-7H,1H2,2H3/b8-4+,9-5+
InChIKeyAHOLMAUBSALKIG-KBXRYBNXSA-N
MW146.19 g/mol
LogP0.24
Rot. Bonds1

About (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine

(2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine (PubChem CID 126703453) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine.

Molecular Properties

Compound Name(2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine
PubChem CID126703453
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name(2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine
SMILESC=C/C=c1/nccn/c1=C/C
InChIInChI=1S/C9H10N2/c1-3-5-9-8(4-2)10-6-7-11-9/h3-7H,1H2,2H3/b8-4+,9-5+
InChIKeyAHOLMAUBSALKIG-KBXRYBNXSA-N
XLogP0.24
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine?
The IUPAC name of (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine (CID 126703453) is (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine.
What is the SMILES notation for (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine?
The canonical SMILES for (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine is C=C/C=c1/nccn/c1=C/C.
What is the InChIKey of (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine?
The InChIKey is AHOLMAUBSALKIG-KBXRYBNXSA-N. The full InChI is InChI=1S/C9H10N2/c1-3-5-9-8(4-2)10-6-7-11-9/h3-7H,1H2,2H3/b8-4+,9-5+.
What are the key properties of (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine?
(2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine has a molecular weight of 146.19 g/mol, XLogP of 0.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3E)-2-ethylidene-3-prop-2-enylidenepyrazine is sourced from PubChem (CID 126703453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).