N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]piperidine-4-carboxamide
Molecular Formula : C13H22N4O | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]piperidine-4-carboxamide is a drug-like molecule.
MolName : N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]piperidine-4-carboxamide |
MolecularFormula : C13H22N4O |
Smiles : O=C(C1CCNCC1)N/N=C1/C(CC2)CCN2C1 |
InChI : InChI=1S/C13H22N4O/c18-13(11-1-5-14-6-2-11)16-15-12-9-17-7-3-10(12)4-8-17/h10-11,14H,1-9H2,(H,16,18) |
InChIK : WAAPNYHFCDRRKX-UHFFFAOYSA-N |
TotalMolweight : 250.345 |
Molweight : 250.345 |
MonoisotopicMass : 250.179361 |
CLogP : 0.6228 |
CLogS : -1.603 |
H Acceptors : 5 |
H Donors : 2 |
TotalSurfaceArea : 195.78 |
Relative PSA : 0.2606 |
PolarSurfaceArea : 56.73 |
Druglikeness : 8.0139 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : acyl-hydrazone |
Shape Index : 0.61111 |
Fragments : 1 |
Non HAtoms : 18 |
NonCHAtoms : 5 |
Electronegative Atoms : 5 |
Rotatable Bond : 2 |
Rings Closures : 3 |
Small Rings : 4 |
Sp3Atoms : 13 |
Symmetricatoms : 4 |
Amines : 2 |
AlkylAmines : 2 |
BasicNitrogens : 2 |
StereoCon : |