3-(2-Methylphenoxy)-3-phenylpropan-1-amine
Basic information
- CAS
109306-10-7- Standard SMILES
Cc1ccccc1OC(CCN)c1ccccc1- InChIKey
QEXPFYRHIYKWEW-UHFFFAOYSA-N- Molecular formula
- C16H19NO
- Average molar mass
- 241.33 g/mol
- Monoisotopic mass
- 241.14666423
Names & identifiers
- Preferred name
- 3-(2-Methylphenoxy)-3-phenylpropan-1-amine
- IUPAC
- 3-(2-methylphenoxy)-3-phenylpropan-1-amine
Names & synonyms
3-(2-methylphenoxy)-3-phenylpropan-1-amine109306-10-7NortomoxetineAtomoxetine impurity 01SCHEMBL2633864DTXSID30911099Benzenepropanamine, gamma-(2-methylphenoxy)-
Database identifiers
- CAS
109306-10-7- PubChem CID
- 184064
- DTXSID
DTXSID30911099
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 225
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Compound notes
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