(3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine

C15H20N4 — CID 166808439

IUPAC(3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine
SMILESC/C=c1/nc(N2CCNCC2)c2cccn2/c1=C/C
InChIInChI=1S/C15H20N4/c1-3-12-13(4-2)19-9-5-6-14(19)15(17-12)18-10-7-16-8-11-18/h3-6,9,16H,7-8,10-11H2,1-2H3/b12-3+,13-4+
InChIKeyFEYVLNSZTCZPRV-VMUJYBKFSA-N
MW256.35 g/mol
LogP0.34
Rot. Bonds1

About (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine

(3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine (PubChem CID 166808439) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name(3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine
PubChem CID166808439
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name(3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine
SMILESC/C=c1/nc(N2CCNCC2)c2cccn2/c1=C/C
InChIInChI=1S/C15H20N4/c1-3-12-13(4-2)19-9-5-6-14(19)15(17-12)18-10-7-16-8-11-18/h3-6,9,16H,7-8,10-11H2,1-2H3/b12-3+,13-4+
InChIKeyFEYVLNSZTCZPRV-VMUJYBKFSA-N
XLogP0.34
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine?
The IUPAC name of (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine (CID 166808439) is (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine.
What is the SMILES notation for (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine?
The canonical SMILES for (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine is C/C=c1/nc(N2CCNCC2)c2cccn2/c1=C/C.
What is the InChIKey of (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine?
The InChIKey is FEYVLNSZTCZPRV-VMUJYBKFSA-N. The full InChI is InChI=1S/C15H20N4/c1-3-12-13(4-2)19-9-5-6-14(19)15(17-12)18-10-7-16-8-11-18/h3-6,9,16H,7-8,10-11H2,1-2H3/b12-3+,13-4+.
What are the key properties of (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine?
(3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine has a molecular weight of 256.35 g/mol, XLogP of 0.34, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,4E)-3,4-di(ethylidene)-1-piperazin-1-ylpyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 166808439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).