2-(2,3-dichlorophenyl)-6-phenylpyrazine

C16H10Cl2N2 — CID 68675412

IUPAC2-(2,3-dichlorophenyl)-6-phenylpyrazine
SMILESClc1cccc(-c2cncc(-c3ccccc3)n2)c1Cl
InChIInChI=1S/C16H10Cl2N2/c17-13-8-4-7-12(16(13)18)15-10-19-9-14(20-15)11-5-2-1-3-6-11/h1-10H
InChIKeyRHDSEUDGLHITHP-UHFFFAOYSA-N
MW301.18 g/mol
LogP5.12
Rot. Bonds2

About 2-(2,3-dichlorophenyl)-6-phenylpyrazine

2-(2,3-dichlorophenyl)-6-phenylpyrazine (PubChem CID 68675412) has the molecular formula C16H10Cl2N2 and a molecular weight of 301.18 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-6-phenylpyrazine.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-6-phenylpyrazine
PubChem CID68675412
Molecular FormulaC16H10Cl2N2
Molecular Weight301.18 g/mol
Exact Mass300.02
IUPAC Name2-(2,3-dichlorophenyl)-6-phenylpyrazine
SMILESClc1cccc(-c2cncc(-c3ccccc3)n2)c1Cl
InChIInChI=1S/C16H10Cl2N2/c17-13-8-4-7-12(16(13)18)15-10-19-9-14(20-15)11-5-2-1-3-6-11/h1-10H
InChIKeyRHDSEUDGLHITHP-UHFFFAOYSA-N
XLogP5.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.18
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-6-phenylpyrazine?
The IUPAC name of 2-(2,3-dichlorophenyl)-6-phenylpyrazine (CID 68675412) is 2-(2,3-dichlorophenyl)-6-phenylpyrazine.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-6-phenylpyrazine?
The canonical SMILES for 2-(2,3-dichlorophenyl)-6-phenylpyrazine is Clc1cccc(-c2cncc(-c3ccccc3)n2)c1Cl.
What is the InChIKey of 2-(2,3-dichlorophenyl)-6-phenylpyrazine?
The InChIKey is RHDSEUDGLHITHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2N2/c17-13-8-4-7-12(16(13)18)15-10-19-9-14(20-15)11-5-2-1-3-6-11/h1-10H.
What are the key properties of 2-(2,3-dichlorophenyl)-6-phenylpyrazine?
2-(2,3-dichlorophenyl)-6-phenylpyrazine has a molecular weight of 301.18 g/mol, XLogP of 5.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-6-phenylpyrazine is sourced from PubChem (CID 68675412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).