58752105 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 9 8 8 7 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 2 2 3 4 4 4 5 5 6 6 7 8 8 9 10 10 11 12 12 12 13 13 14 7 22 9 5 9 12 6 8 7 10 11 13 15 11 14 16 17 18 19 20 14 21 1 1 1 2 1 1 1 2 1 1 1 2 2 1 1 2 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 2 5.5301 7.2622 5.5301 4.6641 4.6641 5.5301 3.7702 6.3961 3.7702 6.3961 5.5301 2.8641 2.8641 3.7773 3.7773 6.9331 4.9101 5.5301 6.1501 2.3284 6.0671 0.8692 1.845 -1.155 -1.155 -0.655 0.345 0.845 -1.1897 -0.655 0.8797 0.345 -2.155 -0.6758 0.3658 -1.8096 1.4996 0.655 -2.155 -2.775 -2.155 -0.9879 2.155 8 8 8 8 8 8 8 8 8 8 8 4 4 5 5 6 6 7 8 9 10 13 5 9 6 8 7 10 11 13 11 14 14 0 Compound Canonicalized 5 2012.05.21 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 290 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 3 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371C0723100000000000000000000000000000000000000304000000000000000810000001F00000800000C0C81980C32C083000200880225525000820000212200088800086CC8082622C0919184700866C601C8D90790C0200E00000000000200000000000000040000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 6-fluoro-4-hydroxy-1-methyl-quinolin-2-one IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 6-fluoro-4-hydroxy-1-methyl-2-quinolinone IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 6-fluoro-4-hydroxy-1-methylquinolin-2-one IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 6-fluoro-4-hydroxy-1-methylquinolin-2-one IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 6-fluoranyl-1-methyl-4-oxidanyl-quinolin-2-one IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 6-fluoro-4-hydroxy-1-methyl-carbostyril InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C10H8FNO2/c1-12-8-3-2-6(11)4-7(8)9(13)5-10(12)14/h2-5,13H,1H3 InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 BUVRGEQJCPXTKX-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2019.06.18 1 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 193.05390666 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C10H8FNO2 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 193.17 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 CN1C2=C(C=C(C=C2)F)C(=CC1=O)O SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 CN1C2=C(C=C(C=C2)F)C(=CC1=O)O Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 40.5 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 193.05390666 14 0 0 0 0 0 0 0 1 -1