Name: Name:1-(3-(Trifluoromethyl)pyridin-2-yl)piperidin-4-one
Brand: AABLOCKS
SKU: AA008NCI
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA008NCI

Chemical Name: 1-(3-(Trifluoromethyl)pyridin-2-yl)piperidin-4-one

CAS Number: 801306-55-8

Molecular Formula: C11H11F3N2O

Molecular Weight: 244.2130

MDL Number: MFCD09927614

SMILES: O=C1CCN(CC1)c1ncccc1C(F)(F)F

Properties

Complexity: 283

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 17

Hydrogen Bond Acceptor Count: 6

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.6

Downstream Synthesis Route

65753-47-1

177-11-7

801306-55-8

[1]Brown,BrianS.;Keddy,Ryan;Zheng,GuoZhu;Schmidt,RobertG.;Koenig,JohnR.;McDonald,HeathA.;Bianchi,BruceR.;Honore,Prisca;Jarvis,MichaelF.;Surowy,CarolS.;Polakowski,JamesS.;Marsh,KennanC.;Faltynek,ConnieR.;Lee,Chih-Hung[BioorganicandMedicinalChemistry,2008,vol.16,#18,p.8516-8525]

[2]CurrentPatentAssignee:ABBVIEINC-US2005/80095,2005,A1Locationinpatent:Page/Pagecolumn20-21;22

[3]CurrentPatentAssignee:ABBOTTLABORATORIESINC-US2005/9841,2005,A1Locationinpatent:Page/Pagecolumn18

37595-74-7

801306-55-8

850040-10-7

[1]CurrentPatentAssignee:ABBVIEINC-US2005/80095,2005,A1Locationinpatent:Page/Pagecolumn21

37595-74-7

801306-55-8

1072921-03-9

[1]Brown,BrianS.;Keddy,Ryan;Zheng,GuoZhu;Schmidt,RobertG.;Koenig,JohnR.;McDonald,HeathA.;Bianchi,BruceR.;Honore,Prisca;Jarvis,MichaelF.;Surowy,CarolS.;Polakowski,JamesS.;Marsh,KennanC.;Faltynek,ConnieR.;Lee,Chih-Hung[BioorganicandMedicinalChemistry,2008,vol.16,#18,p.8516-8525]

[2]CurrentPatentAssignee:ABBVIEINC-US2005/80095,2005,A1Locationinpatent:Page/Pagecolumn22-23

801306-55-8

143-33-9

801306-56-9

[1]CurrentPatentAssignee:EISAICOLTD-EP1627869,2006,A1Locationinpatent:Page/Pagecolumn26-27

801306-54-7

801306-55-8

[1]Locationinpatent:schemeortableLebsack,AlecD.;Rech,JasonC.;Branstetter,BryanJ.;Hawryluk,NatalieA.;Merit,JeffreyE.;Allison,Brett;Rynberg,Raymond;Buma,Johnathan;Rizzolio,Michele;Swanson,Nadia;Ao,Hong;Maher,MichaelP.;Herrmann,Michelle;Freedman,Jamie;Scott,BrianP.;Luo,Lin;Bhattacharya,Anindya;Wang,Qi;Chaplan,SandraR.;Wickenden,AlanD.;Breitenbucher,J.Guy[BioorganicandMedicinalChemistryLetters,2010,vol.20,#23,p.7142-7146]

[2]CurrentPatentAssignee:EISAICOLTD-EP1627869,2006,A1Locationinpatent:Page/Pagecolumn26

[3]Locationinpatent:schemeortableHawryluk,NatalieA.;Merit,JeffreyE.;Lebsack,AlecD.;Branstetter,BryanJ.;Hack,MichaelD.;Swanson,Nadia;Ao,Hong;Maher,MichaelP.;Bhattacharya,Anindya;Wang,Qi;Freedman,JamieM.;Scott,BrianP.;Wickenden,AlanD.;Chaplan,SandraR.;Breitenbucher,J.Guy[BioorganicandMedicinalChemistryLetters,2010,vol.20,#23,p.7137-7141]

801306-55-8 | 1-(3-(Trifluoromethyl)pyridin-2-yl)piperidin-4-one