N-[2-(4-ethylphenoxy)ethyl]-2-methyl-2-propanamine hydrochloride
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Basic information
- CAS
754972-27-5- Standard SMILES
CCc1ccc(OCCNC(C)(C)C)cc1- InChIKey
SXEALRYVJDSJCL-UHFFFAOYSA-N- Molecular formula
- C14H23NO
- Average molar mass
- 221.34 g/mol
- Monoisotopic mass
- 221.17796436
Names & identifiers
- Preferred name
- N-[2-(4-ethylphenoxy)ethyl]-2-methyl-2-propanamine hydrochloride
- IUPAC
- N-[2-(4-ethylphenoxy)ethyl]-2-methylpropan-2-amine
- English name
- 2-Propanamine,N-[2-(4-ethylphenoxy)ethyl]-2-methyl-(9CI)
- Molecular formula
- C14H23NO
- Molecular weight
- 221.33852
Names & synonyms
CHEMBL4928077SCHEMBL22692309AKOS005294603AB00095004-01N-[2-(4-ethylphenoxy)ethyl]-2-methyl-2-propanamine hydrochloride2-Propanamine,N-[2-(4-ethylphenoxy)ethyl]-2-methyl-(9CI)
Database identifiers
- CAS
754972-27-5- PubChem CID
- 2261852
- ChEMBL
CHEMBL4928077
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 178
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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