1,5,6,7,8,9-Hexahydro-2h-cyclohepta[b]pyridin-2-one
Basic information
- CAS
41043-08-7- Standard SMILES
O=c1ccc2c([nH]1)CCCCC2- InChIKey
RWUYOUMKXMHANA-UHFFFAOYSA-N- Molecular formula
- C10H13NO
- Average molar mass
- 163.22 g/mol
- Monoisotopic mass
- 163.09971404
Names & identifiers
- Preferred name
- 1,5,6,7,8,9-Hexahydro-2h-cyclohepta[b]pyridin-2-one
- IUPAC
- 1,5,6,7,8,9-hexahydrocyclohepta[b]pyridin-2-one
Names & synonyms
41043-08-71,5,6,7,8,9-hexahydro-2h-cyclohepta[b]pyridin-2-one1,5,6,7,8,9-hexahydrocyclohepta[b]pyridin-2-one6,7,8,9-Tetrahydro-1H-cyclohepta[b]pyridin-2(5H)-one6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-olUPENN_ABS_008NSC150959DTXSID40302434OA_003NSC-150959
Database identifiers
- CAS
41043-08-7- PubChem CID
- 289265
- DTXSID
DTXSID40302434
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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