Basic information
- CAS
102116-31-4- Standard SMILES
Cc1cccc(N(C)CCCc2ccccc2)c1- InChIKey
IXZRQPOZCVJASU-UHFFFAOYSA-N- Molecular formula
- C17H21N
- Average molar mass
- 239.35 g/mol
- Monoisotopic mass
- 239.16739967
Names & identifiers
- Preferred name
- N,3-dimethyl-N-(3-phenylpropyl)aniline
- IUPAC
- N,3-dimethyl-N-(3-phenylpropyl)aniline
- English name
- N-Methyl-N-(3-methylphenyl)benzenepropanamine
- Molecular weight
- 0
Names & synonyms
SCHEMBL88504833,N-Dimethyl-N-(3-phenylpropyl)anilineN-Methyl-N-(3-methylphenyl)benzenepropanamine
Database identifiers
- CAS
102116-31-4- PubChem CID
- 85529651
- Nikkaji
- J195.899B
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 220
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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