1-(2-Piperidinylmethyl)azepane dihydrochloride
Basic information
- CAS
1219960-55-0- Standard SMILES
C1CCCN(CC2CCCCN2)CC1.Cl.Cl- InChIKey
FULRKQWXMAJLKM-UHFFFAOYSA-N- Molecular formula
- C12H26Cl2N2
- Average molar mass
- 269.25 g/mol
- Monoisotopic mass
- 268.1473042
Names & identifiers
- Preferred name
- 1-(2-Piperidinylmethyl)azepane dihydrochloride
- IUPAC
- 1-(piperidin-2-ylmethyl)azepane;dihydrochloride
Names & synonyms
1219960-55-01-(piperidin-2-ylmethyl)azepane dihydrochloride1-(2-PIPERIDINYLMETHYL)AZEPANE DIHYDROCHLORIDE1-(piperidin-2-ylmethyl)azepane;dihydrochlorideDTXSID801375636AKOS0158454291-(piperidin-2-ylmethyl)azepanedihydrochloride
Database identifiers
- CAS
1219960-55-0- PubChem CID
- 53407948
- DTXSID
DTXSID801375636
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
- 150
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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