N-diazenyl-N-methylmethanimidamide

C2H6N4 — CID 123370111

IUPACN-diazenyl-N-methylmethanimidamide
SMILES[H]/N=C/N(C)/N=N/[H]
InChIInChI=1S/C2H6N4/c1-6(2-3)5-4/h2-4H,1H3/b3-2+,5-4+
InChIKeyUFGYTUYOFGXNKB-MQQKCMAXSA-N
MW86.10 g/mol
LogP0.47
Rot. Bonds2

About N-diazenyl-N-methylmethanimidamide

N-diazenyl-N-methylmethanimidamide (PubChem CID 123370111) has the molecular formula C2H6N4 and a molecular weight of 86.10 g/mol. Its IUPAC name is N-diazenyl-N-methylmethanimidamide.

Molecular Properties

Compound NameN-diazenyl-N-methylmethanimidamide
PubChem CID123370111
Molecular FormulaC2H6N4
Molecular Weight86.10 g/mol
Exact Mass86.06
IUPAC NameN-diazenyl-N-methylmethanimidamide
SMILES[H]/N=C/N(C)/N=N/[H]
InChIInChI=1S/C2H6N4/c1-6(2-3)5-4/h2-4H,1H3/b3-2+,5-4+
InChIKeyUFGYTUYOFGXNKB-MQQKCMAXSA-N
XLogP0.47
TPSA63.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.10
LogP ≤ 50.47
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'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-diazenyl-N-methylmethanimidamide?
The IUPAC name of N-diazenyl-N-methylmethanimidamide (CID 123370111) is N-diazenyl-N-methylmethanimidamide.
What is the SMILES notation for N-diazenyl-N-methylmethanimidamide?
The canonical SMILES for N-diazenyl-N-methylmethanimidamide is [H]/N=C/N(C)/N=N/[H].
What is the InChIKey of N-diazenyl-N-methylmethanimidamide?
The InChIKey is UFGYTUYOFGXNKB-MQQKCMAXSA-N. The full InChI is InChI=1S/C2H6N4/c1-6(2-3)5-4/h2-4H,1H3/b3-2+,5-4+.
What are the key properties of N-diazenyl-N-methylmethanimidamide?
N-diazenyl-N-methylmethanimidamide has a molecular weight of 86.10 g/mol, XLogP of 0.47, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-diazenyl-N-methylmethanimidamide is sourced from PubChem (CID 123370111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).