(E)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,1,1-trifluorobut-3-en-2-one

Formula:C11H14NO3F3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,1,1-trifluorobut-3-en-2-one is a drug-like molecule.

MolName	(E)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,1,1-trifluorobut-3-en-2-one
MolecularFormula	C11H14NO3F3
Smiles	O=C(C(F)(F)F)/C=C/N(CC1)CCC11OCCO1
InChI	InChI=1S/C11H14F3NO3/c12-11(13,14)9(16)1-4-15-5-2-10(3-6-15)17-7-8-18-10/h1,4H,2-3,5-8H2
InChIK	BOZIOYZXXDNBGS-UHFFFAOYSA-N
TotalMolweight	265.23
Molweight	265.23
MonoisotopicMass	265.092578
CLogP	0.6508
CLogS	-1.905
H Acceptors	4
TotalSurfaceArea	183.48
Relative PSA	0.19942
PolarSurfaceArea	38.77
Druglikeness	-35.271
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61111
Fragments	1
Non HAtoms	18
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Sp3Atoms	10
Symmetricatoms	6
StereoCon

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1 - (E)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,1,1-trifluorobut-3-en-2-one | 2 - (E)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,1,1-trifluorobut-3-en-2-one

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