CHEBI:125041 - cyclopropyl-[(1S,5R)-7-[4-(3-fluorophenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name cyclopropyl-[(1S,5R)-7-[4-(3-fluorophenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone
ChEBI ID CHEBI:125041
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H21FN2O
Net Charge 0
Average Mass 336.403
Monoisotopic Mass 336.16379
InChI InChI=1S/C21H21FN2O/c22-17-3-1-2-16(10-17)13-4-6-14(7-5-13)20-18-11-24(12-19(20)23-18)21(25)15-8-9-15/h1-7,10,15,18-20,23H,8-9,11-12H2/t18-,19+,20?
InChIKey RJDMMVWENDWXNN-YOFSQIOKSA-N
SMILES C1CC1C(=O)N2C[C@@H]3C([C@H](C2)N3)C4=CC=C(C=C4)C5=CC(=CC=C5)F
ChEBI Ontology
Outgoing cyclopropyl-[(1S,5R)-7-[4-(3-fluorophenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone (CHEBI:125041) is a piperidines (CHEBI:26151)
Manual Xref Database
LSM-36503 LINCS
View more database links