Basic information
- CAS
69853-01-6- Standard SMILES
CCCCCCCOc1ccccc1NC(=O)OCCCN1CCCCC1- InChIKey
AQARPVMNFGPUSA-UHFFFAOYSA-N- Molecular formula
- C22H36N2O3
- Average molar mass
- 376.5 g/mol
- Monoisotopic mass
- 376.27259301
Names & identifiers
- Preferred name
- Carbamic acid, (2-(heptyloxy)phenyl)-, 3-(1-piperidinyl)propyl ester
- IUPAC
- 3-piperidin-1-ylpropyl N-(2-heptoxyphenyl)carbamate
Names & synonyms
Carbamic acid, (2-(heptyloxy)phenyl)-, 3-(1-piperidinyl)propyl ester69853-01-6DTXSID802201483-(piperidin-1-yl)propyl [2-(heptyloxy)phenyl]carbamate
Database identifiers
- CAS
69853-01-6- PubChem CID
- 47708
- DTXSID
DTXSID80220148- Nikkaji
- J664.195D
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 386
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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