2-[[(E)-3-phenylprop-2-enoyl]amino]ethyl N-cyclohexylcarbamate

Formula:C18H24N2O3 Mutagenic:low Tumorigenic:low Reproductive Effective:none 2-[[(E)-3-phenylprop-2-enoyl]amino]ethyl N-cyclohexylcarbamate is a drug-like molecule.

MolName2-[[(E)-3-phenylprop-2-enoyl]amino]ethyl N-cyclohexylcarbamate
MolecularFormulaC18H24N2O3
SmilesO=C(/C=C/c1ccccc1)NCCOC(NC1CCCCC1)=O
InChIInChI=1S/C18H24N2O3/c21-17(12-11-15-7-3-1-4-8-15)19-13-14-23-18(22)20-16-9-5-2-6-10-16/h1,3-4,7-8,11-12,16H,2,5-6,9-10,13-14H2,(H,19,21)(H,20,22)
InChIKKTZWPVYBMXMKKD-UHFFFAOYSA-N
TotalMolweight316.4
Molweight316.4
MonoisotopicMass316.178693
CLogP2.6765
CLogS-3.947
H Acceptors5
H Donors2
TotalSurfaceArea263.5
Relative PSA0.22391
PolarSurfaceArea67.43
Druglikeness-17.993
Mutageniclow
Tumorigeniclow
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.73913
Fragments1
Non HAtoms23
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond7
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms9
Symmetricatoms4
Amides2
StereoCon

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