Chemryt - We contribute to the Chemicals, Pharmaceutical & Biotech industry using information technology

C16H20N2O (E)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-phenylprop-2-enamide | Chemryt

(E)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-phenylprop-2-enamide

Molecular Formula : C16H20N2O | Mutagenic : none | Tumorigenic : none | Reproductive Effective : |

MolName : (E)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-phenylprop-2-enamide

MolecularFormula : C16H20N2O

Smiles : O=C(/C=C/c1ccccc1)NC1C(CC2)CCN2C1

InChI : InChI=1S/C16H20N2O/c19-16(7-6-13-4-2-1-3-5-13)17-15-12-18-10-8-14(15)9-11-18/h1-7,14-15H,8-12H2,(H,17,19)/t15-/m0/s1

InChIK : ODFSOOCVJPIZNA-HNNXBMFYSA-N

TotalMolweight : 256.348

Molweight : 256.348

MonoisotopicMass : 256.157563

CLogP : 2.061

CLogS : -2.454

H Acceptors : 3

H Donors : 1

TotalSurfaceArea : 206.07

Relative PSA : 0.13612

PolarSurfaceArea : 32.34

Druglikeness : 5.1264

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Shape Index : 0.63158

Fragments : 1

Non HAtoms : 19

NonCHAtoms : 3

Electronegative Atoms : 3

StereoCenters : 1

Rotatable Bond : 3

Rings Closures : 3

Small Rings : 4

Aromatic Rings : 1

Aromatic Atoms : 6

Sp3Atoms : 8

Symmetricatoms : 4

Amides : 1

Amines : 1

AlkylAmines : 1

BasicNitrogens : 1

StereoCon : racemate

Request More Details | (E)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-phenylprop-2-enamide


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments