(E)-3-(2-chlorophenyl)-N-(oxolan-2-ylmethyl)-2-(2-oxopyridin-1-yl)prop-2-enamide

Formula:C19H19N2O3Cl Mutagenic:none Tumorigenic:high Reproductive Effective:none (E)-3-(2-chlorophenyl)-N-(oxolan-2-ylmethyl)-2-(2-oxopyridin-1-yl)prop-2-enamide is a drug-like molecule.

MolName(E)-3-(2-chlorophenyl)-N-(oxolan-2-ylmethyl)-2-(2-oxopyridin-1-yl)prop-2-enamide
MolecularFormulaC19H19N2O3Cl
SmilesO=C(/C(/N(C=CC=C1)C1=O)=C\c(cccc1)c1Cl)NCC1OCCC1
InChIInChI=1S/C19H19ClN2O3/c20-16-8-2-1-6-14(16)12-17(22-10-4-3-9-18(22)23)19(24)21-13-15-7-5-11-25-15/h1-4,6,8-10,12,15H,5,7,11,13H2,(H,21,24)/t15-/m1/s1
InChIKYJMLUZHWKQDBID-OAHLLOKOSA-N
TotalMolweight358.824
Molweight358.824
MonoisotopicMass358.10842
CLogP2.4108
CLogS-3.907
H Acceptors5
H Donors1
TotalSurfaceArea274.19
Relative PSA0.18633
PolarSurfaceArea58.64
Druglikeness1.5795
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.48
Fragments1
Non HAtoms25
NonCHAtoms6
Electronegative Atoms6
StereoCenters1
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms6
Amides2
StereoConracemate

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