2,3-diazido-5,6-diphenylpyrazine

C16H10N8 — CID 14641970

IUPAC2,3-diazido-5,6-diphenylpyrazine
SMILES[N-]=[N+]=Nc1nc(-c2ccccc2)c(-c2ccccc2)nc1N=[N+]=[N-]
InChIInChI=1S/C16H10N8/c17-23-21-15-16(22-24-18)20-14(12-9-5-2-6-10-12)13(19-15)11-7-3-1-4-8-11/h1-10H
InChIKeyQNCZKFDXPBEKJR-UHFFFAOYSA-N
MW314.31 g/mol
LogP5.69
Rot. Bonds4

About 2,3-diazido-5,6-diphenylpyrazine

2,3-diazido-5,6-diphenylpyrazine (PubChem CID 14641970) has the molecular formula C16H10N8 and a molecular weight of 314.31 g/mol. Its IUPAC name is 2,3-diazido-5,6-diphenylpyrazine.

Molecular Properties

Compound Name2,3-diazido-5,6-diphenylpyrazine
PubChem CID14641970
Molecular FormulaC16H10N8
Molecular Weight314.31 g/mol
Exact Mass314.10
IUPAC Name2,3-diazido-5,6-diphenylpyrazine
SMILES[N-]=[N+]=Nc1nc(-c2ccccc2)c(-c2ccccc2)nc1N=[N+]=[N-]
InChIInChI=1S/C16H10N8/c17-23-21-15-16(22-24-18)20-14(12-9-5-2-6-10-12)13(19-15)11-7-3-1-4-8-11/h1-10H
InChIKeyQNCZKFDXPBEKJR-UHFFFAOYSA-N
XLogP5.69
TPSA123.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.31
LogP ≤ 55.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

3-azido-5,6-diphenyl-1,2,4-triazine
CID 15395171
5-azido-3-methyl-2-phenylpyrazine
CID 13065047
2,3,5-triphenyl-6-[4-(3,5,6-triphenylpyrazin-2-yl)phenyl]pyrazine
CID 139681938
4-azido-2-phenylpyrimidine
CID 13157501
2-azido-4,5-diphenylpyridine-3-carbonitrile
CID 71400013
5-azido-3-phenyl-1H-1,2,4-triazole
CID 137205279
2-(2-azidophenyl)-4-phenyl-5-propyl-1,3-oxazole
CID 122373186
1,1'-biphenyl azide
CID 18790861
2-azido-4,6-diphenylpyrimidine;perchloric acid
CID 13157494
sulfanyl 4-[6-azido-5-phenyl-2-(trifluoromethyl)pyrimidin-4-yl]benzoate
CID 173494159
2,3,5,8-tetraphenylpyrazino[2,3-d]pyridazine
CID 134914577
9-(4-azidophenyl)acridine
CID 15340007

Frequently Asked Questions

What is the IUPAC name of 2,3-diazido-5,6-diphenylpyrazine?
The IUPAC name of 2,3-diazido-5,6-diphenylpyrazine (CID 14641970) is 2,3-diazido-5,6-diphenylpyrazine.
What is the SMILES notation for 2,3-diazido-5,6-diphenylpyrazine?
The canonical SMILES for 2,3-diazido-5,6-diphenylpyrazine is [N-]=[N+]=Nc1nc(-c2ccccc2)c(-c2ccccc2)nc1N=[N+]=[N-].
What is the InChIKey of 2,3-diazido-5,6-diphenylpyrazine?
The InChIKey is QNCZKFDXPBEKJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N8/c17-23-21-15-16(22-24-18)20-14(12-9-5-2-6-10-12)13(19-15)11-7-3-1-4-8-11/h1-10H.
What are the key properties of 2,3-diazido-5,6-diphenylpyrazine?
2,3-diazido-5,6-diphenylpyrazine has a molecular weight of 314.31 g/mol, XLogP of 5.69, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diazido-5,6-diphenylpyrazine is sourced from PubChem (CID 14641970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).