2-iodo-6-(4-phenylphenyl)pyrazine

C16H11IN2 — CID 163933131

IUPAC2-iodo-6-(4-phenylphenyl)pyrazine
SMILESIc1cncc(-c2ccc(-c3ccccc3)cc2)n1
InChIInChI=1S/C16H11IN2/c17-16-11-18-10-15(19-16)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H
InChIKeyRKKIAQLCVUYKFX-UHFFFAOYSA-N
MW358.18 g/mol
LogP4.42
Rot. Bonds2

About 2-iodo-6-(4-phenylphenyl)pyrazine

2-iodo-6-(4-phenylphenyl)pyrazine (PubChem CID 163933131) has the molecular formula C16H11IN2 and a molecular weight of 358.18 g/mol. Its IUPAC name is 2-iodo-6-(4-phenylphenyl)pyrazine.

Molecular Properties

Compound Name2-iodo-6-(4-phenylphenyl)pyrazine
PubChem CID163933131
Molecular FormulaC16H11IN2
Molecular Weight358.18 g/mol
Exact Mass358.00
IUPAC Name2-iodo-6-(4-phenylphenyl)pyrazine
SMILESIc1cncc(-c2ccc(-c3ccccc3)cc2)n1
InChIInChI=1S/C16H11IN2/c17-16-11-18-10-15(19-16)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H
InChIKeyRKKIAQLCVUYKFX-UHFFFAOYSA-N
XLogP4.42
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.18
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-methyl-6-(4-phenylphenyl)pyrazine
CID 144588852
ethane;2-methyl-6-(4-phenylphenyl)pyrazine
CID 144588851
2-phenyl-4,6-bis(4-phenylphenyl)pyrimidine
CID 58604250
2-(chloromethyl)-6-phenylpyrazine
CID 177237498
2,3-diphenyl-5-(4-phenylphenyl)pyrazine
CID 58991364
2-phenyl-4-(4-pyridin-4-ylphenyl)-6-[4-(4-pyridin-4-ylphenyl)phenyl]pyrimidine
CID 121289840
4-bromo-6-phenyl-2-(4-phenylphenyl)pyrimidine
CID 122657844
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
2-[4-[3-(3,5-diphenylphenyl)-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]-4,6-diphenylpyridine
CID 58943331
4-[3,5-bis(4-phenylphenyl)phenyl]-2,6-diphenylpyridine
CID 58943272
2,4-diphenyl-6-[4-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]pyridine
CID 58943632
2,4-diphenyl-6-[4-[3-(3-phenylphenyl)phenyl]phenyl]pyrimidine
CID 58943731

Frequently Asked Questions

What is the IUPAC name of 2-iodo-6-(4-phenylphenyl)pyrazine?
The IUPAC name of 2-iodo-6-(4-phenylphenyl)pyrazine (CID 163933131) is 2-iodo-6-(4-phenylphenyl)pyrazine.
What is the SMILES notation for 2-iodo-6-(4-phenylphenyl)pyrazine?
The canonical SMILES for 2-iodo-6-(4-phenylphenyl)pyrazine is Ic1cncc(-c2ccc(-c3ccccc3)cc2)n1.
What is the InChIKey of 2-iodo-6-(4-phenylphenyl)pyrazine?
The InChIKey is RKKIAQLCVUYKFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11IN2/c17-16-11-18-10-15(19-16)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H.
What are the key properties of 2-iodo-6-(4-phenylphenyl)pyrazine?
2-iodo-6-(4-phenylphenyl)pyrazine has a molecular weight of 358.18 g/mol, XLogP of 4.42, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodo-6-(4-phenylphenyl)pyrazine is sourced from PubChem (CID 163933131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).