2-(methoxymethoxy)-N-oxidoethanamine

C4H10NO3- — CID 174746070

IUPAC2-(methoxymethoxy)-N-oxidoethanamine
SMILESCOCOCCN[O-]
InChIInChI=1S/C4H10NO3/c1-7-4-8-3-2-5-6/h5H,2-4H2,1H3/q-1
InChIKeyNRBBTILZNBBQIA-UHFFFAOYSA-N
MW120.13 g/mol
LogP-0.31
Rot. Bonds5

About 2-(methoxymethoxy)-N-oxidoethanamine

2-(methoxymethoxy)-N-oxidoethanamine (PubChem CID 174746070) has the molecular formula C4H10NO3- and a molecular weight of 120.13 g/mol. Its IUPAC name is 2-(methoxymethoxy)-N-oxidoethanamine.

Molecular Properties

Compound Name2-(methoxymethoxy)-N-oxidoethanamine
PubChem CID174746070
Molecular FormulaC4H10NO3-
Molecular Weight120.13 g/mol
Exact Mass120.07
IUPAC Name2-(methoxymethoxy)-N-oxidoethanamine
SMILESCOCOCCN[O-]
InChIInChI=1S/C4H10NO3/c1-7-4-8-3-2-5-6/h5H,2-4H2,1H3/q-1
InChIKeyNRBBTILZNBBQIA-UHFFFAOYSA-N
XLogP-0.31
TPSA53.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.13
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(methoxymethoxy)-N-oxidoethanamine 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 2-(methoxymethoxy)-N-oxidoethanamine?
The IUPAC name of 2-(methoxymethoxy)-N-oxidoethanamine (CID 174746070) is 2-(methoxymethoxy)-N-oxidoethanamine.
What is the SMILES notation for 2-(methoxymethoxy)-N-oxidoethanamine?
The canonical SMILES for 2-(methoxymethoxy)-N-oxidoethanamine is COCOCCN[O-].
What is the InChIKey of 2-(methoxymethoxy)-N-oxidoethanamine?
The InChIKey is NRBBTILZNBBQIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10NO3/c1-7-4-8-3-2-5-6/h5H,2-4H2,1H3/q-1.
What are the key properties of 2-(methoxymethoxy)-N-oxidoethanamine?
2-(methoxymethoxy)-N-oxidoethanamine has a molecular weight of 120.13 g/mol, XLogP of -0.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethoxy)-N-oxidoethanamine is sourced from PubChem (CID 174746070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).