(E)-N-(3-hydroxypropyl)-3-phenylprop-2-enamide

Formula:C12H15NO2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(3-hydroxypropyl)-3-phenylprop-2-enamide is a drug-like molecule.

MolName(E)-N-(3-hydroxypropyl)-3-phenylprop-2-enamide
MolecularFormulaC12H15NO2
SmilesOCCCNC(/C=C/c1ccccc1)=O
InChIInChI=1S/C12H15NO2/c14-10-4-9-13-12(15)8-7-11-5-2-1-3-6-11/h1-3,5-8,14H,4,9-10H2,(H,13,15)
InChIKSEVBHPUMAQYJSX-UHFFFAOYSA-N
TotalMolweight205.256
Molweight205.256
MonoisotopicMass205.110279
CLogP1.3616
CLogS-2.054
H Acceptors3
H Donors2
TotalSurfaceArea176.6
Relative PSA0.21291
PolarSurfaceArea49.33
Druglikeness-1.6076
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.8
Fragments1
Non HAtoms15
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond5
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms4
Symmetricatoms2
Amides1
StereoCon

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