1-[(E)-3-fluoren-9-ylideneprop-1-enyl]piperidine

Formula:C21H21N Mutagenic:high Tumorigenic:high Reproductive Effective:high 1-[(E)-3-fluoren-9-ylideneprop-1-enyl]piperidine is a drug-like molecule.

MolName1-[(E)-3-fluoren-9-ylideneprop-1-enyl]piperidine
MolecularFormulaC21H21N
SmilesC(CC1)CCN1/C=C/C=C1c(cccc2)c2-c2c1cccc2
InChIInChI=1S/C21H21N/c1-6-14-22(15-7-1)16-8-13-21-19-11-4-2-9-17(19)18-10-3-5-12-20(18)21/h2-5,8-13,16H,1,6-7,14-15H2
InChIKAHNREWGUGIURHZ-UHFFFAOYSA-N
TotalMolweight287.405
Molweight287.405
MonoisotopicMass287.167399
CLogP4.819
CLogS-5.302
H Acceptors1
TotalSurfaceArea236.33
Relative PSA0.015021
PolarSurfaceArea3.24
Druglikeness1.1503
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.54545
Fragments1
Non HAtoms22
NonCHAtoms1
Electronegative Atoms1
Rotatable Bond2
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms6
Symmetricatoms8
BasicNitrogens1
StereoCon

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