11-Methylidene-1,5,9-triazabicyclo[7.3.3]pentadecane
Basic information
- CAS
104875-18-5- Standard SMILES
C=C1CN2CCCNCCCN(CCC2)C1- InChIKey
COEPFCJYSHHGQD-UHFFFAOYSA-N- Molecular formula
- C13H25N3
- Average molar mass
- 223.36 g/mol
- Monoisotopic mass
- 223.20484781
Names & identifiers
- Preferred name
- 11-Methylidene-1,5,9-triazabicyclo[7.3.3]pentadecane
- IUPAC
- 11-methylidene-1,5,9-triazabicyclo[7.3.3]pentadecane
Names & synonyms
11-Methylidene-1,5,9-triazabicyclo[7.3.3]pentadecane104875-18-5SCHEMBL4123462DTXSID60546479
Database identifiers
- CAS
104875-18-5- PubChem CID
- 13677181
- DTXSID
DTXSID60546479- Nikkaji
- J1.971.998G
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 207
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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