N-Methyldiethanolamine (C5H13NO2)

N-Methyldiethanolamine presents a C5 framework, alcohol functionality, basic nitrogen (formula C5H13NO2, CAS 105-59-9). ChemicalTool Reaction can propose ranked disconnections for N-Methyldiethanolamine from the SMILES CN(CCO)CCO.

Target: N-Methyldiethanolamine
CAS: 105-59-9
Formula: C5H13NO2
Approx. MW: 119.16
SMILES: CN(CCO)CCO
PubChem CID: 7767
Approx. carbons: C5

N-Methyldiethanolamine structure

Properties

Molecular weight: 119.16

View on PubChem

N-Methyldiethanolamine 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of N-Methyldiethanolamine?

N-Methyldiethanolamine has molecular formula C5H13NO2. Molecular weight about 119.16 g·mol⁻¹.

What is the CAS number of N-Methyldiethanolamine?

The CAS Registry Number for N-Methyldiethanolamine is 105-59-9.

Run AI retrosynthesis for N-Methyldiethanolamine Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C5H13NO2.

Related targets

Similar compounds

Unii-054qw4zamu 3-(Dimethylamino)-1-propanol 5-Amino-1-pentanol N-(2-Hydroxypropyl)ethylenediamine 1-(2-Hydroxyethyl)pyrrolidin-2-one 1-aminobutan-2-ol

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References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.