Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCN(c2ncnc3c2CCC3O)CC1- InChIKey
IGSMZIHHJBZEFR-UHFFFAOYSA-N- Molecular formula
- C16H24N4O3
- Average molar mass
- 320.39 g/mol
Names & identifiers
- Preferred name
- tert-butyl 4-(7-hydroxy-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazine-1-carboxylate
- IUPAC
- tert-butyl 4-(7-hydroxy-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazine-1-carboxylate
Names & synonyms
SCHEMBL191532IGSMZIHHJBZEFR-UHFFFAOYSA-Ntert-butyl 4-(7-hydroxy-6,7-dihydro-5H-cyclopenta [d]pyrimidin-4-yl)piperazine-1-carboxylatetert-butyl 4-(7-hydroxy-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazine-1-carboxylate
Database identifiers
- PubChem CID
- 59670871
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 432
Related reactions
7 records
Compound notes
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