Tert-butyl 3-(3-(methoxy(methyl)amino)propanoyl)azetidine-1-carboxylate

HCID 71304635

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Basic information

CAS: 1402149-12-5
Standard SMILES: CON(C)CCC(=O)C1CN(C(=O)OC(C)(C)C)C1
InChIKey: GXXKRYDVOYUJCD-UHFFFAOYSA-N
Molecular formula: C13H24N2O4
Average molar mass: 272.34 g/mol
Monoisotopic mass: 272.17360725

Names & identifiers

Preferred name: Tert-butyl 3-(3-(methoxy(methyl)amino)propanoyl)azetidine-1-carboxylate
IUPAC: tert-butyl 3-[3-[methoxy(methyl)amino]propanoyl]azetidine-1-carboxylate

Names & synonyms

DTXSID301119772tert-butyl 3-(3-(methoxy(methyl)amino)propanoyl)azetidine-1-carboxylatetert-Butyl 3-(N-methoxy-N-methyl-beta-alanyl)azetidine-1-carboxylate1-Azetidinecarboxylic acid, 3-[3-(methoxymethylamino)-1-oxopropyl]-, 1,1-dimethylethyl ester1402149-12-5

Database identifiers

CAS: 1402149-12-5
PubChem CID: 71304635
DTXSID: DTXSID301119772

Properties

Computed structural properties

XLogP: 0.6
Topological polar surface area: 59.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 19
Formal charge: 0
Complexity: 332

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