hydroxy-(methylaminomethoxy)-oxophosphanium

C2H7NO3P+ — CID 87515079

IUPAChydroxy-(methylaminomethoxy)-oxophosphanium
SMILESCNCO[P+](=O)O
InChIInChI=1S/C2H6NO3P/c1-3-2-6-7(4)5/h3H,2H2,1H3/p+1
InChIKeyDCMJEYZSUDRYFL-UHFFFAOYSA-O
MW124.06 g/mol
LogP-0.17
Rot. Bonds3

About hydroxy-(methylaminomethoxy)-oxophosphanium

hydroxy-(methylaminomethoxy)-oxophosphanium (PubChem CID 87515079) has the molecular formula C2H7NO3P+ and a molecular weight of 124.06 g/mol. Its IUPAC name is hydroxy-(methylaminomethoxy)-oxophosphanium.

Molecular Properties

Compound Namehydroxy-(methylaminomethoxy)-oxophosphanium
PubChem CID87515079
Molecular FormulaC2H7NO3P+
Molecular Weight124.06 g/mol
Exact Mass124.02
IUPAC Namehydroxy-(methylaminomethoxy)-oxophosphanium
SMILESCNCO[P+](=O)O
InChIInChI=1S/C2H6NO3P/c1-3-2-6-7(4)5/h3H,2H2,1H3/p+1
InChIKeyDCMJEYZSUDRYFL-UHFFFAOYSA-O
XLogP-0.17
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.06
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze hydroxy-(methylaminomethoxy)-oxophosphanium 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 hydroxy-(methylaminomethoxy)-oxophosphanium?
The IUPAC name of hydroxy-(methylaminomethoxy)-oxophosphanium (CID 87515079) is hydroxy-(methylaminomethoxy)-oxophosphanium.
What is the SMILES notation for hydroxy-(methylaminomethoxy)-oxophosphanium?
The canonical SMILES for hydroxy-(methylaminomethoxy)-oxophosphanium is CNCO[P+](=O)O.
What is the InChIKey of hydroxy-(methylaminomethoxy)-oxophosphanium?
The InChIKey is DCMJEYZSUDRYFL-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H6NO3P/c1-3-2-6-7(4)5/h3H,2H2,1H3/p+1.
What are the key properties of hydroxy-(methylaminomethoxy)-oxophosphanium?
hydroxy-(methylaminomethoxy)-oxophosphanium has a molecular weight of 124.06 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-(methylaminomethoxy)-oxophosphanium is sourced from PubChem (CID 87515079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).