2-morpholin-4-ylethyl 1-cyclohexylcyclohexane-1-carboxylate
Formula:C19H33NO3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-morpholin-4-ylethyl 1-cyclohexylcyclohexane-1-carboxylate is a drug-like molecule.
| MolName | 2-morpholin-4-ylethyl 1-cyclohexylcyclohexane-1-carboxylate |
| MolecularFormula | C19H33NO3 |
| Smiles | O=C(C1(CCCCC1)C1CCCCC1)OCCN1CCOCC1 |
| InChI | InChI=1S/C19H33NO3/c21-18(23-16-13-20-11-14-22-15-12-20)19(9-5-2-6-10-19)17-7-3-1-4-8-17/h17H,1-16H2 |
| InChIK | KUUXQCUOEPQISM-UHFFFAOYSA-N |
| TotalMolweight | 323.475 |
| Molweight | 323.475 |
| MonoisotopicMass | 323.246044 |
| CLogP | 2.8173 |
| CLogS | -2.906 |
| H Acceptors | 4 |
| TotalSurfaceArea | 264.12 |
| Relative PSA | 0.13854 |
| PolarSurfaceArea | 38.77 |
| Druglikeness | 3.4347 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.56522 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Sp3Atoms | 21 |
| Symmetricatoms | 6 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - 2-morpholin-4-ylethyl 1-cyclohexylcyclohexane-1-carboxylate | 2 - 2-morpholin-4-ylethyl 1-cyclohexylcyclohexane-1-carboxylate
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off