2,2-dimethoxy-N-(1-phenylethyl)ethanamine

HCID 60686999

Notes Reactions

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Basic information

Standard SMILES: COC(CNC(C)c1ccccc1)OC
InChIKey: HBIXOIOMBMDWQG-UHFFFAOYSA-N
Molecular formula: C12H19NO2
Average molar mass: 209.28 g/mol
Monoisotopic mass: 209.14157885

Names & identifiers

Preferred name: 2,2-dimethoxy-N-(1-phenylethyl)ethanamine
IUPAC: 2,2-dimethoxy-N-(1-phenylethyl)ethanamine

Names & synonyms

SCHEMBL1351668AKOS0090645752,2-dimethoxy-N-(1-phenylethyl)ethanamineN-(2,2-dimethoxyethyl)-(1-phenyl)ethylaminebenzenemethanamine, N-(2,2-dimethoxyethyl)-.alpha.-methyl-

Database identifiers

PubChem CID: 60686999

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 30.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 6
Heavy atoms: 15
Formal charge: 0
Complexity: 154

Related reactions

4 records

New reaction record

HRID 494204As productuspto-grants-2009_05

HRID 494205As reactantuspto-grants-2009_05

HRID 559478As productuspto-grants-2011_11

HRID 559479As reactantuspto-grants-2011_11

Compound notes

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