Basic information
- Standard SMILES
CC(C)(C)C(C)(C)Nc1nc(NC(C)(C)C(C)(C)C)nc(N2CC3CCC(CC3)C2)n1- InChIKey
ADUGUNXONVDHOM-UHFFFAOYSA-N- Molecular formula
- C25H46N6
- Average molar mass
- 430.7 g/mol
Names & identifiers
- Preferred name
- 3-{4,6-Bis[(1,1,2,2-tetramethylpropyl)amino]-s-triazin-2-yl}-3-azabicyclo[3.2.2]nonane
- IUPAC
- 6-(3-azabicyclo[3.2.2]nonan-3-yl)-2-N,4-N-bis(2,3,3-trimethylbutan-2-yl)-1,3,5-triazine-2,4-diamine
Names & synonyms
SCHEMBL9705517ADUGUNXONVDHOM-UHFFFAOYSA-N3-{4,6-bis[(1,1,2,2-tetramethylpropyl)amino]-s-triazin-2-yl}-3-azabicyclo[3.2.2]nonane
Database identifiers
- PubChem CID
- 9954415
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 544
Related reactions
2 records
Compound notes
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