8082 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 7 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 3 3 3 4 4 4 5 5 6 6 5 6 17 3 4 7 8 5 11 12 6 9 10 15 16 13 14 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 2.866 2.866 2 3.732 2 3.732 3.2646 2.4675 4.3426 3.9441 1.788 1.3894 3.9441 4.3426 1.3894 1.788 2.866 -0.69 1.31 0.81 0.81 -0.19 -0.19 1.785 1.785 0.7023 1.3926 1.3926 0.7023 -0.7726 -0.0823 -0.0823 -0.7726 -1.31 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.384 Cactvs xemistry.com 2011.09.13 30.9 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.384 Cactvs xemistry.com 2011.09.13 1 Count Hydrogen Bond Donor 5 E_NHDONORS 3.384 Cactvs xemistry.com 2011.09.13 1 Count Rotatable Bond 5 E_NROTBONDS 3.384 Cactvs xemistry.com 2011.09.13 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.384 Cactvs xemistry.com 2011.09.13 00000371C06200000000000000000000000000000000000000002C0000000000000000000000001C00100000000800C10004000002C000000000000000000000000000000000800800000000020080000400000010008000001000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.0.2 LexiChem openeye.com 2011.09.13 piperidine IUPAC Name CAS-like Style 1 2.0.2 LexiChem openeye.com 2011.09.13 piperidine IUPAC Name Preferred 1 2.0.2 LexiChem openeye.com 2011.09.13 piperidine IUPAC Name Systematic 1 2.0.2 LexiChem openeye.com 2011.09.13 piperidine IUPAC Name Traditional 1 2.0.2 LexiChem openeye.com 2011.09.13 piperidine InChI Standard 1 1.0.3 InChI nist.gov 2011.09.13 InChI=1S/C5H11N/c1-2-4-6-5-3-1/h6H,1-5H2 InChIKey Standard 1 1.0.3 InChI nist.gov 2011.09.13 NQRYJNQNLNOLGT-UHFFFAOYSA-N Log P XLogP3 7 3.0 sioc-ccbg.ac.cn 2011.09.13 0.8 Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 85.089149 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 C5H11N Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 85.14754 SMILES Canonical 1 1.7.4 OEChem openeye.com 2011.09.13 C1CCNCC1 SMILES Isomeric 1 1.7.4 OEChem openeye.com 2011.09.13 C1CCNCC1 Topological Polar Surface Area 7 E_TPSA 3.384 Cactvs xemistry.com 2011.09.13 12 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 85.089149 6 0 0 0 0 0 0 0 1 1