Basic information
- CAS
138030-52-1- Standard SMILES
CCOC(=O)C1CCN(Cc2ccc3ccccc3c2)CC1- InChIKey
QMABPSHLNSASFK-UHFFFAOYSA-N- Molecular formula
- C19H23NO2
- Average molar mass
- 297.4 g/mol
- Monoisotopic mass
- 297.17287898
Names & identifiers
- Preferred name
- Ethyl 1-(naphthalen-2-ylmethyl)piperidine-4-carboxylate
- IUPAC
- ethyl 1-(naphthalen-2-ylmethyl)piperidine-4-carboxylate
Names & synonyms
Ethyl 1-(naphthalen-2-ylmethyl)piperidine-4-carboxylate138030-52-1MLS001000557SMR000496061ethyl 1-(2-naphthylmethyl)-4-piperidinecarboxylateethyl1-(naphthalen-2-ylmethyl)piperidine-4-carboxylateOprea1_840300cid_765394SCHEMBL7302723CHEMBL1329346BDBM94325DTXSID801331573
Show more names
HMS2834K04DA-10968AB00078314-011-(2-naphthylmethyl)isonipecotic acid ethyl esterSR-01000202547SR-01000202547-1Ethyl 1-[(naphthalen-2-yl)methyl]piperidine-4-carboxylate1-(2-naphthalenylmethyl)-4-piperidinecarboxylic acid ethyl ester
Database identifiers
- CAS
138030-52-1- PubChem CID
- 765394
- DTXSID
DTXSID801331573- ChEMBL
CHEMBL1329346
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 362
Experimental & physicochemical properties
Solubility25.9 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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