Basic information
- Standard SMILES
CC(C)N1CCC(CC2CCN(c3cnc(C(F)(F)F)nc3)CC2)CC1- InChIKey
DTKADBHDLOHVOU-UHFFFAOYSA-N- Molecular formula
- C19H29F3N4
- Average molar mass
- 370.5 g/mol
Names & identifiers
- Preferred name
- 5-(4-{[1-(1-Methylethyl)-4-piperidinyl]methyl}-1-piperidinyl)-2-(trifluoromethyl)pyrimidine
- IUPAC
- 5-[4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]-2-(trifluoromethyl)pyrimidine
Names & synonyms
5-(4-{[1-(1-Methylethyl)-4-piperidinyl]methyl}-1-piperidinyl)-2-(trifluoromethyl)pyrimidineSCHEMBL4034653
Database identifiers
- PubChem CID
- 11660709
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 419
Related reactions
2 records
Compound notes
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