Butanoic acid, 3-((3-(2-methyl-1-piperidinyl)propyl)amino)-
Basic information
- CAS
90853-24-0- Standard SMILES
CC(CC(=O)O)NCCCN1CCCCC1C- InChIKey
WLQSTVRMKWGVOL-UHFFFAOYSA-N- Molecular formula
- C13H26N2O2
- Average molar mass
- 242.36 g/mol
- Monoisotopic mass
- 242.19942808
Names & identifiers
- Preferred name
- Butanoic acid, 3-((3-(2-methyl-1-piperidinyl)propyl)amino)-
- IUPAC
- 3-[3-(2-methylpiperidin-1-yl)propylamino]butanoic acid
Names & synonyms
90853-24-0Butanoic acid, 3-((3-(2-methyl-1-piperidinyl)propyl)amino)-DTXSID809201113-{[3-(2-METHYLPIPERIDIN-1-YL)PROPYL]AMINO}BUTANOIC ACIDAKOS005848583
Database identifiers
- CAS
90853-24-0- PubChem CID
- 56146
- DTXSID
DTXSID80920111- Nikkaji
- J1.598.146F
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 233
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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