(E)-3-[2-(2-amino-2-oxoethoxy)phenyl]-2-cyano-N-cyclopentylprop-2-enamide

Formula:C17H19N3O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[2-(2-amino-2-oxoethoxy)phenyl]-2-cyano-N-cyclopentylprop-2-enamide is a drug-like molecule.

MolName	(E)-3-[2-(2-amino-2-oxoethoxy)phenyl]-2-cyano-N-cyclopentylprop-2-enamide
MolecularFormula	C17H19N3O3
Smiles	NC(COc1c(/C=C(/C(NC2CCCC2)=O)\C#N)cccc1)=O
InChI	InChI=1S/C17H19N3O3/c18-10-13(17(22)20-14-6-2-3-7-14)9-12-5-1-4-8-15(12)23-11-16(19)21/h1,4-5,8-9,14H,2-3,6-7,11H2,(H2,19,21)(H,20,22)
InChIK	UYVVIXUAHYILHK-UHFFFAOYSA-N
TotalMolweight	313.356
Molweight	313.356
MonoisotopicMass	313.142642
CLogP	1.1555
CLogS	-3.436
H Acceptors	6
H Donors	2
TotalSurfaceArea	252.96
Relative PSA	0.30191
PolarSurfaceArea	105.21
Druglikeness	-3.0927
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	7
Symmetricatoms	2
Amides	2
StereoCon

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