Cuban-1-ylmethanamine
Basic information
- Standard SMILES
NCC12C3C4C5C3C1C5C42- InChIKey
CRHYPLCALPANOH-UHFFFAOYSA-N- Molecular formula
- C9H11N
- Average molar mass
- 133.19 g/mol
- Monoisotopic mass
- 133.08914936
Names & identifiers
- Preferred name
- Cuban-1-ylmethanamine
- IUPAC
- cuban-1-ylmethanamine
Names & synonyms
cuban-1-ylmethanamine150234-60-9Pentacyclo[4.2.0.02,5.03,8.04,7]octane-1-methanamineCHEMBL2763171-(cuban-1-yl)methanamineNSC124082(cuban-1-yl)methanamineC-Cuban-1-yl-methylamineSCHEMBL4732949BDBM50057301MFCD19204783AKOS006341453
Show more names
NSC-124082SB13673CS-0089036EN300-387923
Database identifiers
- PubChem CID
- 276346
- ChEMBL
CHEMBL276317- Nikkaji
- J828.989A
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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