Name: Name:5-(hydroxymethyl)-1-methyl-6-[4-(trifluoromethyl)phenyl]piperidin-2-one
Brand: Angene
SKU: AG01AJPG
Rating: 90 (10 reviews)

5-(hydroxymethyl)-1-methyl-6-[4-(trifluoromethyl)phenyl]piperidin-2-one

CAS No.:

1334146-81-4

Catalog Number:

AG01AJPG

Molecular Formula:

C14H16F3NO2

Molecular Weight:

287.2775

Catalog Number:

AG01AJPG

Chemical Name:

5-(hydroxymethyl)-1-methyl-6-[4-(trifluoromethyl)phenyl]piperidin-2-one

CAS Number:

1334146-81-4

Molecular Formula:

C14H16F3NO2

Molecular Weight:

287.2775

MDL Number:

MFCD19686315

IUPAC Name:

5-(hydroxymethyl)-1-methyl-6-[4-(trifluoromethyl)phenyl]piperidin-2-one

InChI:

InChI=1S/C14H16F3NO2/c1-18-12(20)7-4-10(8-19)13(18)9-2-5-11(6-3-9)14(15,16)17/h2-3,5-6,10,13,19H,4,7-8H2,1H3

InChI Key:

DYIIYIKGNDYPKR-UHFFFAOYSA-N

SMILES:

OCC1CCC(=O)N(C1c1ccc(cc1)C(F)(F)F)C

Complexity:

351

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

287.113g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

287.282g/mol

Monoisotopic Mass:

287.113g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8