{3-[((1R)-1-phenylethyl)amino]propyl}benzylamine
Basic information
- CAS
282104-39-6- Standard SMILES
C[C@@H](NCCCNCc1ccccc1)c1ccccc1- InChIKey
DPNYTCRMUJTUIZ-MRXNPFEDSA-N- Molecular formula
- C18H24N2
- Average molar mass
- 268.4 g/mol
- Monoisotopic mass
- 268.19394877
Names & identifiers
- Preferred name
- {3-[((1R)-1-phenylethyl)amino]propyl}benzylamine
- IUPAC
- N-benzyl-N'-[(1R)-1-phenylethyl]propane-1,3-diamine
Names & synonyms
{3-[((1R)-1-phenylethyl)amino]propyl}benzylamine282104-39-6N-benzyl-N'-[(1R)-1-phenylethyl]propane-1,3-diamineST016947DTXSID90427429SBB001052AKOS024276816N(1)-BENZYL-N(3)-(1-PHENYLETHYL)-1,3-PROPANEDIAMINEN~1~-Benzyl-N~3~-[(1R)-1-phenylethyl]propane-1,3-diamine
Database identifiers
- CAS
282104-39-6- PubChem CID
- 7022293
- DTXSID
DTXSID90427429
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 230
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Compound notes
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