Basic information
- CAS
355382-77-3- Standard SMILES
O=[N+]([O-])c1ccccc1CNC1C2CC3CC(C2)CC1C3- InChIKey
OPAIDXBKFDKJEL-UHFFFAOYSA-N- Molecular formula
- C17H22N2O2
- Average molar mass
- 286.37 g/mol
- Monoisotopic mass
- 286.16812795
Names & identifiers
- Preferred name
- N-[(2-nitrophenyl)methyl]adamantan-2-amine
- IUPAC
- N-[(2-nitrophenyl)methyl]adamantan-2-amine
Names & synonyms
N-[(2-nitrophenyl)methyl]adamantan-2-amine355382-77-3N-[(2-Nitrophenyl)methyl]tricyclo[3.3.1.13,7]decan-2-amineCambridge id 5557789Oprea1_056520Oprea1_267696SCHEMBL33615352-adamantyl(2-nitrobenzyl)amineDTXSID701192376N-(2-nitrobenzyl)-2-adamantanamineSTK145846AKOS000546491
Show more names
adamantan-2-yl[(2-nitrophenyl)methyl]amineST45112228AB00089051-01AG-690/11822770N-(2-nitrobenzyl)tricyclo[3.3.1.1~3,7~]decan-2-amineN-[(2-nitrophenyl)methyl]adamantan-2-amine--oxalic acid (1/1)
Database identifiers
- CAS
355382-77-3- PubChem CID
- 792005
- DTXSID
DTXSID701192376
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 57.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…