Basic information
- CAS
90477-16-0- Standard SMILES
CC(C(=O)NC12CC3CC(CC(C3)C1)C2)N1CCN(c2ccccn2)CC1- InChIKey
FVYBUHOQALPTGF-UHFFFAOYSA-N- Molecular formula
- C22H32N4O
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.25761166
Names & identifiers
- Preferred name
- N-(adamantan-1-yl)-2-[4-(pyridin-2-yl)piperazin-1-yl]propanamide
- IUPAC
- N-(1-adamantyl)-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide
Names & synonyms
DTXSID801139050AKOS034353472WAY-63150990477-16-0SR-01000052979SR-01000052979-1Z44529688N-(adamantan-1-yl)-2-[4-(pyridin-2-yl)piperazin-1-yl]propanamideI+/--Methyl-4-(2-pyridinyl)-N-tricyclo[3.3.1.13,7]dec-1-yl-1-piperazineacetamide
Database identifiers
- CAS
90477-16-0- PubChem CID
- 4591104
- DTXSID
DTXSID801139050
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 48.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 515
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…