Basic information
- CAS
93450-23-8- Standard SMILES
CCCCOCc1cccc(NC(=O)OCCN2CCCCC2)c1- InChIKey
VRUGVQZIXOJVPR-UHFFFAOYSA-N- Molecular formula
- C19H30N2O3
- Average molar mass
- 334.5 g/mol
- Monoisotopic mass
- 334.22564282
Names & identifiers
- Preferred name
- 2-(Piperidin-1-yl)ethyl [3-(butoxymethyl)phenyl]carbamate
- IUPAC
- 2-piperidin-1-ylethyl N-[3-(butoxymethyl)phenyl]carbamate
Names & synonyms
DTXSID7087845093450-23-82-(Piperidin-1-yl)ethyl [3-(butoxymethyl)phenyl]carbamate[3-(Butoxymethyl)phenyl]carbamic acid, 2-(1-piperidinyl)ethyl ester
Database identifiers
- CAS
93450-23-8- PubChem CID
- 54514
- DTXSID
DTXSID70878450- Nikkaji
- J1.539.257F
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 346
Experimental & physicochemical properties
LogP3.21
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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