1-methyl-N-(2,4,4-trimethylpentan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine
Basic information
- CAS
5418-04-2- Standard SMILES
Cn1ncc2c(NC(C)(C)CC(C)(C)C)ncnc21- InChIKey
ZRJANANMUOFDQM-UHFFFAOYSA-N- Molecular formula
- C14H23N5
- Average molar mass
- 261.37 g/mol
- Monoisotopic mass
- 261.19534575
Names & identifiers
- Preferred name
- 1-methyl-N-(2,4,4-trimethylpentan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine
- IUPAC
- 1-methyl-N-(2,4,4-trimethylpentan-2-yl)pyrazolo[3,4-d]pyrimidin-4-amine
Names & synonyms
NSC11652NSC-116525418-04-2
Database identifiers
- CAS
5418-04-2- PubChem CID
- 223741
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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