N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide

C2H9N3O2 — CID 163900411

IUPACN-(2-hydroxy-2-methylhydrazinyl)methanamine oxide
SMILESCN(O)N[NH+](C)[O-]
InChIInChI=1S/C2H9N3O2/c1-4(6)3-5(2)7/h3-4,7H,1-2H3
InChIKeyQJIUYAAZFDVBTG-UHFFFAOYSA-N
MW107.11 g/mol
LogP-2.26
Rot. Bonds2

About N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide

N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide (PubChem CID 163900411) has the molecular formula C2H9N3O2 and a molecular weight of 107.11 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylhydrazinyl)methanamine oxide
PubChem CID163900411
Molecular FormulaC2H9N3O2
Molecular Weight107.11 g/mol
Exact Mass107.07
IUPAC NameN-(2-hydroxy-2-methylhydrazinyl)methanamine oxide
SMILESCN(O)N[NH+](C)[O-]
InChIInChI=1S/C2H9N3O2/c1-4(6)3-5(2)7/h3-4,7H,1-2H3
InChIKeyQJIUYAAZFDVBTG-UHFFFAOYSA-N
XLogP-2.26
TPSA63.00 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.11
LogP ≤ 5-2.26
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 N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide?
The IUPAC name of N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide (CID 163900411) is N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide.
What is the SMILES notation for N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide?
The canonical SMILES for N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide is CN(O)N[NH+](C)[O-].
What is the InChIKey of N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide?
The InChIKey is QJIUYAAZFDVBTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H9N3O2/c1-4(6)3-5(2)7/h3-4,7H,1-2H3.
What are the key properties of N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide?
N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide has a molecular weight of 107.11 g/mol, XLogP of -2.26, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylhydrazinyl)methanamine oxide is sourced from PubChem (CID 163900411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).