3-(aminomethyl)-N,N'-diethyl-N,N'-dimethyl-3-naphthalen-1-ylpentane-1,5-diamine
Basic information
- CAS
27558-08-3- Standard SMILES
CCN(C)CCC(CN)(CCN(C)CC)c1cccc2ccccc12- InChIKey
CBRFWYHJJGFEMM-UHFFFAOYSA-N- Molecular formula
- C22H35N3
- Average molar mass
- 341.5 g/mol
- Monoisotopic mass
- 341.28309813
Names & identifiers
- Preferred name
- 3-(aminomethyl)-N,N'-diethyl-N,N'-dimethyl-3-naphthalen-1-ylpentane-1,5-diamine
- IUPAC
- 3-(aminomethyl)-N,N'-diethyl-N,N'-dimethyl-3-naphthalen-1-ylpentane-1,5-diamine
Names & synonyms
27558-08-3DTXSID903056573-(aminomethyl)-N,N'-diethyl-N,N'-dimethyl-3-naphthalen-1-ylpentane-1,5-diamineRefChem:275055DTXCID00256787NSC171369NSC-1713693-(Aminomethyl)-N~1~,N~5~-diethyl-N~1~,N~5~-dimethyl-3-(naphthalen-1-yl)pentane-1,5-diamine
Database identifiers
- CAS
27558-08-3- PubChem CID
- 298977
- DTXSID
DTXSID90305657
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 32.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 356
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Compound notes
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