Basic information
- CAS
28224-66-0- Standard SMILES
CCCCCCc1cnc(N)[nH]c1=O- InChIKey
SBJNEBFTRDQNPE-UHFFFAOYSA-N- Molecular formula
- C10H17N3O
- Average molar mass
- 195.26 g/mol
- Monoisotopic mass
- 195.13716217
Names & identifiers
- Preferred name
- 4(1H)-Pyrimidinone, 2-amino-5-hexyl-
- IUPAC
- 2-amino-5-hexyl-1H-pyrimidin-6-one
Names & synonyms
4(1H)-Pyrimidinone, 2-amino-5-hexyl-28224-66-02-Amino-5-hexyl-4(1H)-pyrimidinoneDTXSID601824772-amino-5-hexylpyrimidin-4(3H)-one
Database identifiers
- CAS
28224-66-0- PubChem CID
- 147277
- DTXSID
DTXSID60182477
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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