Basic information
- Standard SMILES
c1cncc(N2C[C@H]3CNC[C@H]32)c1- InChIKey
XHYQJTGLPJMMEB-PSASIEDQSA-N- Molecular formula
- C10H13N3
- Average molar mass
- 175.23 g/mol
Names & identifiers
- Preferred name
- (1R,5S)-6-(3-pyridinyl)-3,6-diazabicyclo[3.2.0]heptane
- IUPAC
- (1R,5S)-6-pyridin-3-yl-3,6-diazabicyclo[3.2.0]heptane
Names & synonyms
CHEMBL430178SCHEMBL649263XHYQJTGLPJMMEB-PSASIEDQSA-NBDBM50224454(1R,5S)-6-(3-pyridinyl)-3 ,6-diazabicyclo[3.2.0]heptane(1R,5S)-6-(3-pyridinyl)-3,6-diazabicyclo[3.2.0]heptane(1R,5S)-6-pyridin-3-yl-3,6-diaza-bicyclo[3.2.0]heptane
Database identifiers
- PubChem CID
- 9855608
- ChEMBL
CHEMBL430178
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 195
Related reactions
5 records
Compound notes
Loading…