56838295 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 8 7 7 7 7 6 6 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 2 2 2 3 3 3 4 4 5 5 5 6 6 6 7 7 7 8 8 8 9 9 9 10 10 10 11 11 12 13 14 15 15 16 16 17 17 18 18 18 19 19 19 20 20 21 21 22 22 23 23 24 24 25 25 26 27 28 29 29 29 24 25 6 12 41 12 14 16 13 14 17 18 19 7 8 30 9 31 32 10 33 34 11 35 36 11 37 38 39 40 13 15 22 20 21 23 42 26 27 24 43 44 25 45 46 26 47 27 48 28 49 28 29 50 51 52 53 54 55 56 57 58 59 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 2 1 2 1 1 1 1 1 1 1 1 1 2 1 2 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 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 12.1279 5.855 4.5981 5.5443 10.1279 5.1871 5.4978 4.2086 4.8299 3.5408 3.8514 5.5443 6.1279 4.5981 7.1279 3.732 9.1279 10.6279 10.6279 7.6279 7.6279 3.732 2.866 11.6279 11.6279 8.6279 8.6279 2.866 2 4.9945 6.0447 5.8803 3.6822 4.4399 5.3563 4.5987 2.9938 3.1582 3.8309 3.2376 6.4616 3.732 10.7356 10.0453 10.0453 10.7356 7.3179 7.3179 3.732 12.2105 11.5202 11.5202 12.2105 8.9379 8.9379 2.3291 2.31 1.4631 1.69 -1.5972 0.1581 -1.0972 -2.4019 -1.5972 0.9024 1.8529 0.6961 2.5972 1.4404 2.391 -0.7925 -1.5972 -2.0972 -1.5972 -0.5972 -1.5972 -0.7312 -2.4632 -2.4632 -0.7312 -2.5972 -1.0972 -0.7312 -2.4632 -2.4632 -0.7312 -2.0972 -0.5972 0.313 1.5609 2.3408 0.3685 0.1209 2.9248 3.1724 1.7325 0.9525 3.0106 2.4783 0.2859 0.0228 -0.1206 -0.5191 -2.6753 -3.0738 -3.0002 -0.1942 -3.2172 -0.5191 -0.1206 -3.0738 -2.6753 -3.0002 -0.1942 -2.4072 -0.0603 -0.2872 -1.1341 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 3 3 3 4 4 12 14 15 15 16 17 17 20 21 22 23 12 14 16 13 14 13 22 20 21 23 26 27 26 27 28 28 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 511 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 4 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 4 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371E07BA0000000000000000000000000000001600000003C788100000000005801F000001E00100000000C28E19F063FF09FCC1C00A0033667640082802D3112A009D8A03874988A68E2C09991972008689002D8C8271080800E08000000000000001000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N-cyclohexyl-6-methyl-2-(4-morpholinophenyl)imidazo[1,2-a]pyridin-3-amine IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N-cyclohexyl-6-methyl-2-[4-(4-morpholinyl)phenyl]-3-imidazo[1,2-a]pyridinamine IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 <I>N</I>-cyclohexyl-6-methyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-3-amine IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N-cyclohexyl-6-methyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-3-amine IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N-cyclohexyl-6-methyl-2-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyridin-3-amine IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 cyclohexyl-[6-methyl-2-(4-morpholinophenyl)imidazo[1,2-a]pyridin-3-yl]amine InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C24H30N4O/c1-18-7-12-22-26-23(24(28(22)17-18)25-20-5-3-2-4-6-20)19-8-10-21(11-9-19)27-13-15-29-16-14-27/h7-12,17,20,25H,2-6,13-16H2,1H3 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 ITCJJNJMYCQGTM-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 5.7 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 390.24196159 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C24H30N4O Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 390.5 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 CC1=CN2C(=NC(=C2NC3CCCCC3)C4=CC=C(C=C4)N5CCOCC5)C=C1 SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 CC1=CN2C(=NC(=C2NC3CCCCC3)C4=CC=C(C=C4)N5CCOCC5)C=C1 Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 41.8 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 390.24196159 29 0 0 0 0 0 0 0 1 -1