Basic information
- Standard SMILES
Br.Br.c1ccc(CN2CC3CC2CN3)cc1- InChIKey
SOMPEQIPSQFVMO-UHFFFAOYSA-N- Molecular formula
- C12H18Br2N2
- Average molar mass
- 350.09 g/mol
Names & identifiers
- Preferred name
- 2-Benzyl-2,5-diazabicyclo[2.2.1]heptane dihydrobromide
- IUPAC
- 2-benzyl-2,5-diazabicyclo[2.2.1]heptane;dihydrobromide
Names & synonyms
2-benzyl-2,5-diazabicyclo[2.2.1]heptane dihydrobromide100944-15-8C12H18Br2N22-benzyl-2,5-diazabicyclo(2.2.1)heptane dihydrobromideSCHEMBL5857053SOMPEQIPSQFVMO-UHFFFAOYSA-NMFCD01321292AKOS000279973AKOS024386630SB48440DB-060866CS-0265748
Show more names
ST51038457EN300-2975022-benzyl-2,5-diazabicyclo[2.2.1]heptane;dihydrobromide2-benzyl-2,5-diazabicyclo[2.2.1]heptane, bromide, bromide(1S,4S)-2-Benzyl-2,5-diazabicyclo-[2.2.1]heptane dihydrobromide5-(phenylmethyl)-2,5-diazabicyclo(2.2.1)heptane dihydrobromide
Database identifiers
- PubChem CID
- 16637464
Properties
Computed structural properties
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 198
Related reactions
2 records
Compound notes
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