tert-butyl 4-(5-(1-(4-(trifluoromethyl)phenyl)piperidin-4-yloxy)-2,3-dihydro-1H-inden-1-ylamino)piperidine-1-carboxylate
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Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(NC2CCc3cc(OC4CCN(c5ccc(C(F)(F)F)cc5)CC4)ccc32)CC1- InChIKey
KXNHURZRBCWTFV-UHFFFAOYSA-N- Molecular formula
- C31H40F3N3O3
- Average molar mass
- 559.7 g/mol
- Monoisotopic mass
- 559.30217663
Names & identifiers
- Preferred name
- tert-butyl 4-(5-(1-(4-(trifluoromethyl)phenyl)piperidin-4-yloxy)-2,3-dihydro-1H-inden-1-ylamino)piperidine-1-carboxylate
- IUPAC
- tert-butyl 4-[[5-[1-[4-(trifluoromethyl)phenyl]piperidin-4-yl]oxy-2,3-dihydro-1H-inden-1-yl]amino]piperidine-1-carboxylate
Names & synonyms
tert-butyl 4-(5-(1-(4-(trifluoromethyl)phenyl)piperidin-4-yloxy)-2,3-dihydro-1H-inden-1-ylamino)piperidine-1-carboxylateSCHEMBL648726
Database identifiers
- PubChem CID
- 57765814
Properties
Computed structural propertiesFilling in
- XLogP
- 6.4
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 826
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Related reactions
8 records
Compound notes
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