N-[(Z)-3-(cyclopentylamino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]benzamide

Formula:C19H20N2O3 Mutagenic:high Tumorigenic:none Reproductive Effective:none N-[(Z)-3-(cyclopentylamino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolNameN-[(Z)-3-(cyclopentylamino)-1-(furan-2-yl)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormulaC19H20N2O3
SmilesO=C(/C(/NC(c1ccccc1)=O)=C/c1ccco1)NC1CCCC1
InChIInChI=1S/C19H20N2O3/c22-18(14-7-2-1-3-8-14)21-17(13-16-11-6-12-24-16)19(23)20-15-9-4-5-10-15/h1-3,6-8,11-13,15H,4-5,9-10H2,(H,20,23)(H,21,22)
InChIKNPMGAOVXKXSUEL-UHFFFAOYSA-N
TotalMolweight324.379
Molweight324.379
MonoisotopicMass324.147393
CLogP3.1175
CLogS-4.352
H Acceptors5
H Donors2
TotalSurfaceArea259.88
Relative PSA0.24284
PolarSurfaceArea71.34
Druglikeness0.64721
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms24
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms5
Symmetricatoms4
Amides2
StereoCon

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