[2-[methoxy(oxido)azaniumyl]hydrazinyl]methane

C2H9N3O2 — CID 163789007

IUPAC[2-[methoxy(oxido)azaniumyl]hydrazinyl]methane
SMILESCNN[NH+]([O-])OC
InChIInChI=1S/C2H9N3O2/c1-3-4-5(6)7-2/h3-5H,1-2H3
InChIKeyMVBBNTJSBIBIKL-UHFFFAOYSA-N
MW107.11 g/mol
LogP-2.43
Rot. Bonds3

About [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane

[2-[methoxy(oxido)azaniumyl]hydrazinyl]methane (PubChem CID 163789007) has the molecular formula C2H9N3O2 and a molecular weight of 107.11 g/mol. Its IUPAC name is [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane.

Molecular Properties

Compound Name[2-[methoxy(oxido)azaniumyl]hydrazinyl]methane
PubChem CID163789007
Molecular FormulaC2H9N3O2
Molecular Weight107.11 g/mol
Exact Mass107.07
IUPAC Name[2-[methoxy(oxido)azaniumyl]hydrazinyl]methane
SMILESCNN[NH+]([O-])OC
InChIInChI=1S/C2H9N3O2/c1-3-4-5(6)7-2/h3-5H,1-2H3
InChIKeyMVBBNTJSBIBIKL-UHFFFAOYSA-N
XLogP-2.43
TPSA60.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.11
LogP ≤ 5-2.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane?
The IUPAC name of [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane (CID 163789007) is [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane.
What is the SMILES notation for [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane?
The canonical SMILES for [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane is CNN[NH+]([O-])OC.
What is the InChIKey of [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane?
The InChIKey is MVBBNTJSBIBIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H9N3O2/c1-3-4-5(6)7-2/h3-5H,1-2H3.
What are the key properties of [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane?
[2-[methoxy(oxido)azaniumyl]hydrazinyl]methane has a molecular weight of 107.11 g/mol, XLogP of -2.43, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[methoxy(oxido)azaniumyl]hydrazinyl]methane is sourced from PubChem (CID 163789007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).