Basic information
- CAS
63662-78-2- Standard SMILES
N#Cc1nc2c(n(O)c1=N)CCCCCCCCCC2- InChIKey
ZLMBDXRRDQSUNG-UHFFFAOYSA-N- Molecular formula
- C15H22N4O
- Average molar mass
- 274.36 g/mol
- Monoisotopic mass
- 274.17936134
Names & identifiers
- Preferred name
- 4-Hydroxy-3-imino-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyrazine-2-carbonitrile
- IUPAC
- 4-hydroxy-3-imino-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyrazine-2-carbonitrile
Names & synonyms
63662-78-2NSC2689174-hydroxy-3-imino-5,6,7,8,9,10,11,12,13,14-decahydrocyclododeca[b]pyrazine-2-carbonitrileDTXSID20313326NSC-2689174-Hydroxy-3-imino-3,4,5,6,7,8,9,10,11,12,13,14-dodecahydrocyclododeca[b]pyrazine-2-carbonitrile
Database identifiers
- CAS
63662-78-2- PubChem CID
- 320652
- DTXSID
DTXSID20313326
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 483
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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