(2,6-dimethylphenyl)azaniumylideneazanide

C8H10N2 — CID 154722803

IUPAC(2,6-dimethylphenyl)azaniumylideneazanide
SMILESCc1cccc(C)c1[NH+]=[N-]
InChIInChI=1S/C8H10N2/c1-6-4-3-5-7(2)8(6)10-9/h3-5,10H,1-2H3
InChIKeyAEQHHEXASATDDT-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.04
Rot. Bonds1

About (2,6-dimethylphenyl)azaniumylideneazanide

(2,6-dimethylphenyl)azaniumylideneazanide (PubChem CID 154722803) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is (2,6-dimethylphenyl)azaniumylideneazanide.

Molecular Properties

Compound Name(2,6-dimethylphenyl)azaniumylideneazanide
PubChem CID154722803
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name(2,6-dimethylphenyl)azaniumylideneazanide
SMILESCc1cccc(C)c1[NH+]=[N-]
InChIInChI=1S/C8H10N2/c1-6-4-3-5-7(2)8(6)10-9/h3-5,10H,1-2H3
InChIKeyAEQHHEXASATDDT-UHFFFAOYSA-N
XLogP1.04
TPSA36.27 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylphenyl)azaniumylideneazanide?
The IUPAC name of (2,6-dimethylphenyl)azaniumylideneazanide (CID 154722803) is (2,6-dimethylphenyl)azaniumylideneazanide.
What is the SMILES notation for (2,6-dimethylphenyl)azaniumylideneazanide?
The canonical SMILES for (2,6-dimethylphenyl)azaniumylideneazanide is Cc1cccc(C)c1[NH+]=[N-].
What is the InChIKey of (2,6-dimethylphenyl)azaniumylideneazanide?
The InChIKey is AEQHHEXASATDDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-6-4-3-5-7(2)8(6)10-9/h3-5,10H,1-2H3.
What are the key properties of (2,6-dimethylphenyl)azaniumylideneazanide?
(2,6-dimethylphenyl)azaniumylideneazanide has a molecular weight of 134.18 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylphenyl)azaniumylideneazanide is sourced from PubChem (CID 154722803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).