2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine

C36H32N6 — CID 139611350

IUPAC2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine
SMILESCc1ccnc(C=Cc2nc(C=Cc3cc(C)ccn3)c(C=Cc3cc(C)ccn3)nc2C=Cc2cc(C)ccn2)c1
InChIInChI=1S/C36H32N6/c1-25-13-17-37-29(21-25)5-9-33-34(10-6-30-22-26(2)14-18-38-30)42-36(12-8-32-24-28(4)16-20-40-32)35(41-33)11-7-31-23-27(3)15-19-39-31/h5-24H,1-4H3
InChIKeyOWLIUCKFAURULZ-UHFFFAOYSA-N
MW548.69 g/mol
LogP7.97
Rot. Bonds8

About 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine

2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine (PubChem CID 139611350) has the molecular formula C36H32N6 and a molecular weight of 548.69 g/mol. Its IUPAC name is 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine.

Molecular Properties

Compound Name2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine
PubChem CID139611350
Molecular FormulaC36H32N6
Molecular Weight548.69 g/mol
Exact Mass548.27
IUPAC Name2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine
SMILESCc1ccnc(C=Cc2nc(C=Cc3cc(C)ccn3)c(C=Cc3cc(C)ccn3)nc2C=Cc2cc(C)ccn2)c1
InChIInChI=1S/C36H32N6/c1-25-13-17-37-29(21-25)5-9-33-34(10-6-30-22-26(2)14-18-38-30)42-36(12-8-32-24-28(4)16-20-40-32)35(41-33)11-7-31-23-27(3)15-19-39-31/h5-24H,1-4H3
InChIKeyOWLIUCKFAURULZ-UHFFFAOYSA-N
XLogP7.97
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500548.69
LogP ≤ 57.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(E)-2-(4-methyl-2-pyridinyl)ethenyl]phenol
CID 143748192
4-methyl-2-[(E)-pent-1-enyl]pyridine
CID 59772955
2,3,5,6-tetrakis[2-(3-methyl-2-pyridinyl)ethenyl]pyrazine
CID 54468117
3-[(4-methyl-2-pyridinyl)methylidene]-2-benzofuran-1-one
CID 85442187
tris(4-methyl-2-(4-methyl-2-pyridinyl)pyridine);ruthenium(2+)
CID 154828609
copper;bis(4-methyl-2-(4-methyl-2-pyridinyl)pyridine)
CID 23557697
(NE,R)-2-methyl-N-[(4-methyl-2-pyridinyl)methylidene]propane-2-sulfinamide
CID 164536455
2-[(E)-2-(3-methylphenyl)ethenyl]pyridine
CID 5463079
trimethyl-(4-methyl-2-pyridinyl)silane
CID 15169002
4-methyl-2-(4-methyl-2-pyridinyl)pyridine;oxovanadium
CID 139924983
1,1-dimethyl-2-(4-methyl-2-pyridinyl)hydrazine
CID 20747440
N,N,4-trimethylpyridin-2-amine
CID 18797061

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine?
The IUPAC name of 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine (CID 139611350) is 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine.
What is the SMILES notation for 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine?
The canonical SMILES for 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine is Cc1ccnc(C=Cc2nc(C=Cc3cc(C)ccn3)c(C=Cc3cc(C)ccn3)nc2C=Cc2cc(C)ccn2)c1.
What is the InChIKey of 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine?
The InChIKey is OWLIUCKFAURULZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H32N6/c1-25-13-17-37-29(21-25)5-9-33-34(10-6-30-22-26(2)14-18-38-30)42-36(12-8-32-24-28(4)16-20-40-32)35(41-33)11-7-31-23-27(3)15-19-39-31/h5-24H,1-4H3.
What are the key properties of 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine?
2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine has a molecular weight of 548.69 g/mol, XLogP of 7.97, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetrakis[2-(4-methyl-2-pyridinyl)ethenyl]pyrazine is sourced from PubChem (CID 139611350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).