Basic information
- CAS
93450-24-9- Standard SMILES
CCCCCOCc1cccc(NC(=O)OCCN2CCCCC2)c1- InChIKey
IXXRZUONESQMDP-UHFFFAOYSA-N- Molecular formula
- C20H32N2O3
- Average molar mass
- 348.5 g/mol
- Monoisotopic mass
- 348.24129289
Names & identifiers
- Preferred name
- 2-(Piperidin-1-yl)ethyl {3-[(pentyloxy)methyl]phenyl}carbamate
- IUPAC
- 2-piperidin-1-ylethyl N-[3-(pentoxymethyl)phenyl]carbamate
Names & synonyms
DTXSID0087852993450-24-92-(Piperidin-1-yl)ethyl {3-[(pentyloxy)methyl]phenyl}carbamate[3-[(Pentyloxy)methyl]phenyl]carbamic acid, 2-(1-piperidinyl)ethyl ester
Database identifiers
- CAS
93450-24-9- PubChem CID
- 54516
- DTXSID
DTXSID00878529- Nikkaji
- J1.539.263K
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 359
Experimental & physicochemical properties
LogP3.69
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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