70477587 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 3 3 3 4 4 4 5 5 5 6 6 6 7 7 7 8 8 8 9 9 9 10 10 10 10 11 11 11 12 12 12 13 13 13 14 14 14 15 15 16 16 16 17 17 17 18 18 19 20 20 20 21 21 21 22 22 23 24 15 22 23 23 24 4 5 25 26 6 27 28 7 29 30 8 31 32 9 33 34 14 35 36 15 37 38 11 12 39 40 13 41 42 16 43 44 17 45 46 18 47 48 49 50 20 51 52 19 53 54 19 55 56 21 57 58 59 60 61 24 62 63 64 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 2 1 1 1 18 14 55 19 17 56 3 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 9.7942 10.2942 8.0622 7.1962 8.0622 7.1962 8.9282 6.3301 8.9282 3.732 3.732 2.866 4.5981 6.3301 9.7942 2.866 4.5981 5.4641 5.4641 2 2 8.9852 10.6032 9.2942 8.2742 8.6728 6.9841 6.5856 7.8501 7.4516 7.4082 7.8067 9.1403 9.5388 6.1181 5.7196 8.7162 8.3176 3.9441 4.3426 3.52 3.1215 2.654 2.2554 4.8101 5.2087 6.5422 6.9407 10.0063 10.4048 3.0781 3.4766 4.386 3.9875 4.9272 6.001 1.788 1.3894 1.38 2 2.62 8.3956 11.1929 8.9298 6.4806 8.0194 2.4806 1.9806 3.4806 0.9806 3.9806 0.4806 4.9806 -5.0194 -4.0194 -5.5194 -3.5194 -0.5194 5.4806 -6.5194 -2.5194 -1.0194 -2.0194 -7.0194 -8.0194 7.0684 7.0684 8.0194 1.898 2.5882 2.5632 1.8729 4.0632 3.3729 0.398 1.0882 3.398 4.0882 1.0632 0.3729 5.5632 4.8729 -5.602 -4.9118 -3.4368 -4.1271 -4.9368 -5.6271 -4.102 -3.4118 -1.102 -0.4118 4.898 5.5882 -7.102 -6.4118 -1.9368 -2.6271 -0.7094 -2.3294 -6.4368 -7.1271 -8.0194 -8.6394 -8.0194 6.8768 6.8768 8.521 8 8 8 8 1 8 1 1 2 2 18 22 22 23 23 24 19 24 0 Compound Canonicalized 5 2012.11.26 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 275 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 1 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 17 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371F07B0000000000000000000000000000000160000000000000000000000000018000001C00000000000800C102042F90170C1000A0003067640000802D3112A00948001830088048020089001400000880028800231080800000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 1-nonadec-10-enylimidazole IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 1-nonadec-10-enylimidazole IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 1-nonadec-10-enylimidazole IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 1-nonadec-10-enylimidazole IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 1-nonadec-10-enylimidazole IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 1-nonadec-10-enylimidazole InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C22H40N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-24-21-19-23-22-24/h9-10,19,21-22H,2-8,11-18,20H2,1H3 InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 WQSIWQMCEBCHAA-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2019.06.18 8.4 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 332.319149284 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C22H40N2 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 332.6 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 CCCCCCCCC=CCCCCCCCCCN1C=CN=C1 SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 CCCCCCCCC=CCCCCCCCCCN1C=CN=C1 Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 17.8 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 332.319149284 24 0 0 0 1 0 1 0 1 -1