(E)-3-(1,3-benzodioxol-5-yl)-N-morpholin-4-ylprop-2-enamide

Formula:C14H16N2O4 Mutagenic:none Tumorigenic:high Reproductive Effective:high (E)-3-(1,3-benzodioxol-5-yl)-N-morpholin-4-ylprop-2-enamide is a drug-like molecule.

MolName	(E)-3-(1,3-benzodioxol-5-yl)-N-morpholin-4-ylprop-2-enamide
MolecularFormula	C14H16N2O4
Smiles	O=C(/C=C/c(cc1)cc2c1OCO2)NN1CCOCC1
InChI	InChI=1S/C14H16N2O4/c17-14(15-16-5-7-18-8-6-16)4-2-11-1-3-12-13(9-11)20-10-19-12/h1-4,9H,5-8,10H2,(H,15,17)
InChIK	GIQKBRHVSHUTMB-UHFFFAOYSA-N
TotalMolweight	276.291
Molweight	276.291
MonoisotopicMass	276.111008
CLogP	0.3481
CLogS	-2.501
H Acceptors	6
H Donors	1
TotalSurfaceArea	211.07
Relative PSA	0.27503
PolarSurfaceArea	60.03
Druglikeness	1.2343
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	low
Nasty Functions
Shape Index	0.65
Fragments	1
Non HAtoms	20
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	9
Symmetricatoms	2
StereoCon

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