Mls003171200
Basic information
- CAS
31414-56-9- Standard SMILES
CN1CCCCC1Cc1ccccc1- InChIKey
OXIVWFPBZQTUTR-UHFFFAOYSA-N- Molecular formula
- C13H19N
- Average molar mass
- 189.3 g/mol
- Monoisotopic mass
- 189.15174961
Names & identifiers
- Preferred name
- Mls003171200
- IUPAC
- 2-benzyl-1-methylpiperidine
Names & synonyms
MLS00317120031414-56-9DTXSID70320702RefChem:357347DTXCID902718232-benzyl-1-methylpiperidineNSC363741benzyl methyl piperidineSCHEMBL2606119SCHEMBL8106512CHEMBL1882212NSC-363741
Show more names
SMR001875106DB-392651
Database identifiers
- CAS
31414-56-9- PubChem CID
- 338916
- DTXSID
DTXSID70320702- ChEMBL
CHEMBL1882212- Nikkaji
- J562.470C
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 161
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Related reactions
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Compound notes
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