N,N-Diethyl-2-(2-phenylpropoxy)propan-1-amine
Basic information
- CAS
27078-40-6- Standard SMILES
CCN(CC)CC(C)OCC(C)c1ccccc1- InChIKey
TVWXPPPJLSLWLK-UHFFFAOYSA-N- Molecular formula
- C16H27NO
- Average molar mass
- 249.39 g/mol
- Monoisotopic mass
- 249.20926449
Names & identifiers
- Preferred name
- N,N-Diethyl-2-(2-phenylpropoxy)propan-1-amine
- IUPAC
- N,N-diethyl-2-(2-phenylpropoxy)propan-1-amine
- English name
- N,N-Diethyl-3-[(β-methylphenethyl)oxy]propan-1-amine
- Molecular formula
- C16H27NO
- Molecular weight
- 249.39
Names & synonyms
n,n-diethyl-2-(2-phenylpropoxy)propan-1-amineDTXSID7094983627078-40-6RefChem:1090433DTXCID101378015BRN 2455161N,N-Diethyl-3-((beta-methylphenethyl)oxy)propylaminePropylamine, N,N-diethyl-3-((beta-methylphenethyl)oxy)-1-Propanamine, N,N-diethyl-3-(2-phenylpropoxy)-N,N-Diethyl-3-[(β-methylphenethyl)oxy]propan-1-amine
Database identifiers
- CAS
27078-40-6- PubChem CID
- 213813
- DTXSID
DTXSID70949836
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 197
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Compound notes
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