Basic information
- CAS
90853-23-9- Standard SMILES
CC(NCCCN1CCCCC1C)C(=O)O- InChIKey
OBONDRBGULWHJT-UHFFFAOYSA-N- Molecular formula
- C12H24N2O2
- Average molar mass
- 228.33 g/mol
- Monoisotopic mass
- 228.18377801
Names & identifiers
- Preferred name
- N-(3-(2-Methyl-1-piperidinyl)propyl)alanine
- IUPAC
- 2-[3-(2-methylpiperidin-1-yl)propylamino]propanoic acid
Names & synonyms
90853-23-9N-(3-(2-METHYL-1-PIPERIDINYL)PROPYL)ALANINEDTXSID40920112AKOS010986990N-[3-(2-Methylpiperidin-1-yl)propyl]alanine
Database identifiers
- CAS
90853-23-9- PubChem CID
- 56145
- DTXSID
DTXSID40920112
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 221
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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