4134169 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 8 8 7 7 7 7 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 2 3 3 3 4 4 4 5 5 5 6 6 7 7 7 8 8 8 9 9 10 11 11 12 12 13 13 14 15 15 16 16 17 17 18 20 20 21 22 22 23 23 24 24 25 10 19 7 10 31 11 12 34 17 19 37 14 18 8 9 26 9 27 28 29 30 11 32 33 13 15 14 16 19 20 35 21 36 18 22 23 21 38 39 24 40 25 41 25 42 43 2 2 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 1 2 2 2 1 1 1 1 1 1 2 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 3.8 6.3981 4.666 5.5321 4.666 4.666 3.8 2.8 3.3 4.666 5.5321 6.3981 6.3981 5.5321 7.2641 7.2641 3.8 3.8 5.5321 8.1301 8.1301 2.9061 2.9061 2 2 3.6395 2.2174 2.6923 3.775 2.8251 5.203 6.1426 5.7441 4.9951 7.2641 7.2641 4.666 8.6671 8.6671 2.9132 2.9132 1.4643 1.4643 1.127 -3.373 2.627 0.127 -3.373 -1.373 3.127 3.127 3.993 1.627 1.127 -0.373 -1.373 -1.873 0.127 -1.873 -2.873 -1.873 -2.873 -0.373 -1.373 -3.4077 -1.3384 -2.8938 -1.8522 2.5281 3.339 2.5164 4.3915 4.3915 2.937 1.0193 1.7096 -0.183 0.747 -2.493 -3.993 -0.063 -1.683 -4.0276 -0.7184 -3.2059 -1.5401 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 5 5 6 6 12 12 13 14 15 16 17 17 18 20 22 23 24 17 19 14 18 13 15 16 19 20 21 18 22 23 21 24 25 25 0 Compound Canonicalized 5 2019.01.04 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 558 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 4 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 3 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 5 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 00000371E07BB000000000000000000000001800000000000000306080000000000000814000001E00100000000C28C1980430C082C00000A80325725400820000210200088881A874980860B2C095B1942008609600C8C8071C88808E00000000000200200000000000040040000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-cyclopropyl-2-[2-(3-oxo-4H-quinoxalin-2-yl)anilino]acetamide IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-cyclopropyl-2-[2-(3-oxo-4H-quinoxalin-2-yl)anilino]acetamide IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 <I>N</I>-cyclopropyl-2-[2-(3-oxo-4<I>H</I>-quinoxalin-2-yl)anilino]acetamide IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-cyclopropyl-2-[2-(3-oxo-4H-quinoxalin-2-yl)anilino]acetamide IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-cyclopropyl-2-[[2-(3-oxidanylidene-4H-quinoxalin-2-yl)phenyl]amino]ethanamide IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-cyclopropyl-2-[2-(3-keto-4H-quinoxalin-2-yl)anilino]acetamide InChI Standard 1 1.0.6 InChI iupac.org 2021.05.07 InChI=1S/C19H18N4O2/c24-17(21-12-9-10-12)11-20-14-6-2-1-5-13(14)18-19(25)23-16-8-4-3-7-15(16)22-18/h1-8,12,20H,9-11H2,(H,21,24)(H,23,25) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.05.07 ZLMBUWODFFEYBD-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.05.07 2.2 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 334.14297583 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 C19H18N4O2 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 334.4 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1CC1NC(=O)CNC2=CC=CC=C2C3=NC4=CC=CC=C4NC3=O SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1CC1NC(=O)CNC2=CC=CC=C2C3=NC4=CC=CC=C4NC3=O Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 82.6 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 334.14297583 25 0 0 0 0 0 0 0 1 -1