2-aminoacetaldehyde;methoxymethanamine

C4H12N2O2 — CID 91432479

IUPAC2-aminoacetaldehyde;methoxymethanamine
SMILESCOCN.NCC=O
InChIInChI=1S/C2H7NO.C2H5NO/c1-4-2-3;3-1-2-4/h2-3H2,1H3;2H,1,3H2
InChIKeyYYTJGPQHVCHRTG-UHFFFAOYSA-N
MW120.15 g/mol
LogP-1.31
Rot. Bonds2

About 2-aminoacetaldehyde;methoxymethanamine

2-aminoacetaldehyde;methoxymethanamine (PubChem CID 91432479) has the molecular formula C4H12N2O2 and a molecular weight of 120.15 g/mol. Its IUPAC name is 2-aminoacetaldehyde;methoxymethanamine.

Molecular Properties

Compound Name2-aminoacetaldehyde;methoxymethanamine
PubChem CID91432479
Molecular FormulaC4H12N2O2
Molecular Weight120.15 g/mol
Exact Mass120.09
IUPAC Name2-aminoacetaldehyde;methoxymethanamine
SMILESCOCN.NCC=O
InChIInChI=1S/C2H7NO.C2H5NO/c1-4-2-3;3-1-2-4/h2-3H2,1H3;2H,1,3H2
InChIKeyYYTJGPQHVCHRTG-UHFFFAOYSA-N
XLogP-1.31
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.15
LogP ≤ 5-1.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-aminoacetaldehyde;methoxymethanamine?
The IUPAC name of 2-aminoacetaldehyde;methoxymethanamine (CID 91432479) is 2-aminoacetaldehyde;methoxymethanamine.
What is the SMILES notation for 2-aminoacetaldehyde;methoxymethanamine?
The canonical SMILES for 2-aminoacetaldehyde;methoxymethanamine is COCN.NCC=O.
What is the InChIKey of 2-aminoacetaldehyde;methoxymethanamine?
The InChIKey is YYTJGPQHVCHRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7NO.C2H5NO/c1-4-2-3;3-1-2-4/h2-3H2,1H3;2H,1,3H2.
What are the key properties of 2-aminoacetaldehyde;methoxymethanamine?
2-aminoacetaldehyde;methoxymethanamine has a molecular weight of 120.15 g/mol, XLogP of -1.31, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoacetaldehyde;methoxymethanamine is sourced from PubChem (CID 91432479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).