Basic information
- Standard SMILES
CCCCc1nc2c(c(=O)[nH]1)CN(C(C)=O)CC2- InChIKey
JKZRIXVJKPBFQV-UHFFFAOYSA-N- Molecular formula
- C13H19N3O2
- Average molar mass
- 249.31 g/mol
Names & identifiers
- Preferred name
- 6-Acetyl-2-butyl-5,6,7,8-tetrahydro-pyrido-[4,3-d]pyrimidin-4(3H)-one
- IUPAC
- 6-acetyl-2-butyl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
Names & synonyms
SCHEMBL9437290JKZRIXVJKPBFQV-UHFFFAOYSA-N6-Acetyl-2-butyl-5,6,7,8-tetrahydro-pyrido-[4,3-d]pyrimidin-4(3H)-one
Database identifiers
- PubChem CID
- 136014034
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 438
Related reactions
1 records
Compound notes
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