856590 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 8 7 7 7 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 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 11 12 13 14 14 15 15 16 16 17 17 18 19 19 20 20 21 21 21 22 22 23 23 24 47 5 11 36 11 13 14 12 13 6 7 25 8 26 27 9 28 29 10 30 31 10 32 33 34 35 12 15 16 17 37 19 20 18 38 18 21 39 22 40 23 41 42 43 44 24 45 24 46 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 2 1 1 2 1 2 1 2 1 1 1 1 1 1 2 1 1 1 1 2 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 10.1279 5.855 4.5981 5.5443 5.1871 5.4978 4.2086 4.8299 3.5408 3.8514 5.5443 6.1279 4.5981 3.732 7.1279 3.732 2.866 2.866 7.6279 7.6279 2 8.6279 8.6279 9.1279 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 3.732 2.3291 7.3179 7.3179 2.31 1.4631 1.69 8.9379 8.9379 10.4379 -1.5972 0.1581 -1.0972 -2.4019 0.9024 1.8529 0.6961 2.5972 1.4404 2.391 -0.7925 -1.5972 -2.0972 -0.5972 -1.5972 -2.5972 -1.0972 -2.0972 -0.7312 -2.4632 -0.5972 -0.7312 -2.4632 -1.5972 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 -3.2172 -2.4072 -0.1942 -3.0002 -0.0603 -0.2872 -1.1341 -0.1942 -3.0002 -2.1341 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 3 3 3 4 4 11 13 14 15 15 16 17 19 20 22 23 11 13 14 12 13 12 16 17 19 20 18 18 22 23 24 24 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 404 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 3 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 3 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371E07B20000000000000000000000000000001600000003C608000000000005801F000001E00100800000C2CC19F043FB69FCC1A00A0033667640082802D3132A009D8A03E7C98886EE2C299939470086CD013C8D82790D0830E20000000000000004000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-[3-(cyclohexylamino)-6-methyl-imidazo[1,2-a]pyridin-2-yl]phenol IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-[3-(cyclohexylamino)-6-methyl-2-imidazo[1,2-a]pyridinyl]phenol IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-[3-(cyclohexylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]phenol IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-[3-(cyclohexylamino)-6-methyl-imidazo[1,2-a]pyridin-2-yl]phenol IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 4-[3-(cyclohexylamino)-6-methyl-imidazo[1,2-a]pyridin-2-yl]phenol InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C20H23N3O/c1-14-7-12-18-22-19(15-8-10-17(24)11-9-15)20(23(18)13-14)21-16-5-3-2-4-6-16/h7-13,16,21,24H,2-6H2,1H3 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 ARTIMRDZLIRIGD-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 5.6 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 321.184112366 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C20H23N3O Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 321.4 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 CC1=CN2C(=NC(=C2NC3CCCCC3)C4=CC=C(C=C4)O)C=C1 SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 CC1=CN2C(=NC(=C2NC3CCCCC3)C4=CC=C(C=C4)O)C=C1 Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 49.6 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 321.184112366 24 0 0 0 0 0 0 0 1 -1