(methylperoxyamino)oxymethane;hydrochloride

C2H8ClNO3 — CID 22015712

IUPAC(methylperoxyamino)oxymethane;hydrochloride
SMILESCONOOC.Cl
InChIInChI=1S/C2H7NO3.ClH/c1-4-3-6-5-2;/h3H,1-2H3;1H
InChIKeyWKUFTSAHUPDKNF-UHFFFAOYSA-N
MW129.54 g/mol
LogP0.05
Rot. Bonds3

About (methylperoxyamino)oxymethane;hydrochloride

(methylperoxyamino)oxymethane;hydrochloride (PubChem CID 22015712) has the molecular formula C2H8ClNO3 and a molecular weight of 129.54 g/mol. Its IUPAC name is (methylperoxyamino)oxymethane;hydrochloride.

Molecular Properties

Compound Name(methylperoxyamino)oxymethane;hydrochloride
PubChem CID22015712
Molecular FormulaC2H8ClNO3
Molecular Weight129.54 g/mol
Exact Mass129.02
IUPAC Name(methylperoxyamino)oxymethane;hydrochloride
SMILESCONOOC.Cl
InChIInChI=1S/C2H7NO3.ClH/c1-4-3-6-5-2;/h3H,1-2H3;1H
InChIKeyWKUFTSAHUPDKNF-UHFFFAOYSA-N
XLogP0.05
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.54
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (methylperoxyamino)oxymethane;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (methylperoxyamino)oxymethane;hydrochloride?
The IUPAC name of (methylperoxyamino)oxymethane;hydrochloride (CID 22015712) is (methylperoxyamino)oxymethane;hydrochloride.
What is the SMILES notation for (methylperoxyamino)oxymethane;hydrochloride?
The canonical SMILES for (methylperoxyamino)oxymethane;hydrochloride is CONOOC.Cl.
What is the InChIKey of (methylperoxyamino)oxymethane;hydrochloride?
The InChIKey is WKUFTSAHUPDKNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7NO3.ClH/c1-4-3-6-5-2;/h3H,1-2H3;1H.
What are the key properties of (methylperoxyamino)oxymethane;hydrochloride?
(methylperoxyamino)oxymethane;hydrochloride has a molecular weight of 129.54 g/mol, XLogP of 0.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (methylperoxyamino)oxymethane;hydrochloride is sourced from PubChem (CID 22015712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).