Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester
Basic information
- CAS
63884-41-3- Standard SMILES
CC1CCCCN1CCCOC(=O)CCc1ccccc1- InChIKey
ASKZGJDEXADJKD-UHFFFAOYSA-N- Molecular formula
- C18H27NO2
- Average molar mass
- 289.4 g/mol
- Monoisotopic mass
- 289.2041791
Names & identifiers
- Preferred name
- Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl ester
- IUPAC
- 3-(2-methylpiperidin-1-yl)propyl 3-phenylpropanoate
- English name
- 3-Phenylpropanoic acid 3-(2-methylpiperidino)propyl ester
- Molecular formula
- C18H27NO2
- Molecular weight
- 289.41
Names & synonyms
63884-41-3Hydrocinnamic acid, 3-(2'-methylpiperidino)propyl esterRefChem:10870003-(2'-Methylpiperidino)propyl hydrocinnamate3-(2-methylpiperidin-1-yl)propyl 3-phenylpropanoate3-Phenylpropanoic acid 3-(2-methylpiperidino)propyl esterDTXSID50980686DB-304851Benzenepropanoic acid, 3-(2-methyl-1-piperidinyl)propyl ester
Database identifiers
- CAS
63884-41-3- PubChem CID
- 64914
- DTXSID
DTXSID50980686- Nikkaji
- J86.745D
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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