2-diazenyl-N'-methylprop-2-enimidamide

C4H8N4 — CID 129147718

IUPAC2-diazenyl-N'-methylprop-2-enimidamide
SMILES[H]/N=N/C(=C)/C(N)=N/C
InChIInChI=1S/C4H8N4/c1-3(8-6)4(5)7-2/h6H,1H2,2H3,(H2,5,7)/b8-6+
InChIKeyDQOAVUPCKKYDFG-SOFGYWHQSA-N
MW112.14 g/mol
LogP0.52
Rot. Bonds2

About 2-diazenyl-N'-methylprop-2-enimidamide

2-diazenyl-N'-methylprop-2-enimidamide (PubChem CID 129147718) has the molecular formula C4H8N4 and a molecular weight of 112.14 g/mol. Its IUPAC name is 2-diazenyl-N'-methylprop-2-enimidamide.

Molecular Properties

Compound Name2-diazenyl-N'-methylprop-2-enimidamide
PubChem CID129147718
Molecular FormulaC4H8N4
Molecular Weight112.14 g/mol
Exact Mass112.07
IUPAC Name2-diazenyl-N'-methylprop-2-enimidamide
SMILES[H]/N=N/C(=C)/C(N)=N/C
InChIInChI=1S/C4H8N4/c1-3(8-6)4(5)7-2/h6H,1H2,2H3,(H2,5,7)/b8-6+
InChIKeyDQOAVUPCKKYDFG-SOFGYWHQSA-N
XLogP0.52
TPSA74.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.14
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-diazenyl-N'-methylprop-2-enimidamide?
The IUPAC name of 2-diazenyl-N'-methylprop-2-enimidamide (CID 129147718) is 2-diazenyl-N'-methylprop-2-enimidamide.
What is the SMILES notation for 2-diazenyl-N'-methylprop-2-enimidamide?
The canonical SMILES for 2-diazenyl-N'-methylprop-2-enimidamide is [H]/N=N/C(=C)/C(N)=N/C.
What is the InChIKey of 2-diazenyl-N'-methylprop-2-enimidamide?
The InChIKey is DQOAVUPCKKYDFG-SOFGYWHQSA-N. The full InChI is InChI=1S/C4H8N4/c1-3(8-6)4(5)7-2/h6H,1H2,2H3,(H2,5,7)/b8-6+.
What are the key properties of 2-diazenyl-N'-methylprop-2-enimidamide?
2-diazenyl-N'-methylprop-2-enimidamide has a molecular weight of 112.14 g/mol, XLogP of 0.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diazenyl-N'-methylprop-2-enimidamide is sourced from PubChem (CID 129147718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).