imino-(4-phenyldiazenylphenyl)iminoazanium

C12H10N5+ — CID 6332310

IUPACimino-(4-phenyldiazenylphenyl)iminoazanium
SMILESN=[N+]=Nc1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C12H10N5/c13-17-16-12-8-6-11(7-9-12)15-14-10-4-2-1-3-5-10/h1-9,13H/q+1
InChIKeyONHPYMJTBPGOIV-UHFFFAOYSA-N
MW224.25 g/mol
LogP4.28
Rot. Bonds3

About imino-(4-phenyldiazenylphenyl)iminoazanium

imino-(4-phenyldiazenylphenyl)iminoazanium (PubChem CID 6332310) has the molecular formula C12H10N5+ and a molecular weight of 224.25 g/mol. Its IUPAC name is imino-(4-phenyldiazenylphenyl)iminoazanium.

Molecular Properties

Compound Nameimino-(4-phenyldiazenylphenyl)iminoazanium
PubChem CID6332310
Molecular FormulaC12H10N5+
Molecular Weight224.25 g/mol
Exact Mass224.09
IUPAC Nameimino-(4-phenyldiazenylphenyl)iminoazanium
SMILESN=[N+]=Nc1ccc(/N=N/c2ccccc2)cc1
InChIInChI=1S/C12H10N5/c13-17-16-12-8-6-11(7-9-12)15-14-10-4-2-1-3-5-10/h1-9,13H/q+1
InChIKeyONHPYMJTBPGOIV-UHFFFAOYSA-N
XLogP4.28
TPSA75.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.25
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of imino-(4-phenyldiazenylphenyl)iminoazanium?
The IUPAC name of imino-(4-phenyldiazenylphenyl)iminoazanium (CID 6332310) is imino-(4-phenyldiazenylphenyl)iminoazanium.
What is the SMILES notation for imino-(4-phenyldiazenylphenyl)iminoazanium?
The canonical SMILES for imino-(4-phenyldiazenylphenyl)iminoazanium is N=[N+]=Nc1ccc(/N=N/c2ccccc2)cc1.
What is the InChIKey of imino-(4-phenyldiazenylphenyl)iminoazanium?
The InChIKey is ONHPYMJTBPGOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N5/c13-17-16-12-8-6-11(7-9-12)15-14-10-4-2-1-3-5-10/h1-9,13H/q+1.
What are the key properties of imino-(4-phenyldiazenylphenyl)iminoazanium?
imino-(4-phenyldiazenylphenyl)iminoazanium has a molecular weight of 224.25 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imino-(4-phenyldiazenylphenyl)iminoazanium is sourced from PubChem (CID 6332310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).