11493927 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 17 17 8 8 7 7 7 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 2 3 4 4 5 5 5 6 6 6 7 7 8 8 8 8 9 9 10 10 10 11 11 11 12 12 13 13 14 14 15 16 17 17 18 18 19 20 21 21 22 40 41 15 19 22 12 13 14 9 15 35 16 20 9 10 11 23 12 24 13 25 26 14 27 28 29 30 31 32 33 34 16 17 18 36 19 21 20 37 22 38 39 1 1 2 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 1 2 1 1 1 2 1 2 1 1 9 6 12 8 24 2 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 4.6746 4.6746 5.6012 9.1455 2.3947 4.7352 6.4673 1.8947 3.8692 2.4467 0.5457 3.6104 3.353 1.0457 5.6012 6.4673 7.3333 8.1993 8.1993 7.3333 9.1455 9.7291 1.4437 4.3611 1.8751 2.6978 0 0.2674 4.1934 3.3507 3.6235 3.9067 1.324 0.5 4.7352 7.3333 7.3333 9.3382 10.3491 5.6746 5.6746 0 2.9322 9.4844 6.6797 8.7588 7.9844 6.9844 7.8928 8.4844 6.5035 8.5222 9.4504 6.9261 9.3882 8.4844 7.9844 8.4844 7.9844 6.9844 6.4844 8.2892 7.4844 7.4673 8.8619 6.2634 5.9366 8.8165 7.9682 9.6612 10.0134 6.3682 7.205 9.9422 9.6825 7.3644 9.1044 5.8644 8.8785 7.4844 0 2.9322 8 8 8 8 6 8 8 8 8 8 8 4 4 7 7 9 16 17 18 18 19 21 19 22 16 20 6 17 18 19 21 20 22 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 381 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 3 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371E07330000600000000000000000000000001200000002C58B160000000005801F800001E00100000000D2CE19E063C86D3C81440A803BD77D40482882037622008D8A1BF6CD80E6672C4B5BB973928E4D611D8E987BC5F037E00000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N-[(3R)-quinuclidin-3-yl]furo[2,3-c]pyridine-5-carboxamide;dihydrochloride IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-5-furo[2,3-c]pyridinecarboxamide;dihydrochloride IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 <I>N</I>-[(3<I>R</I>)-1-azabicyclo[2.2.2]octan-3-yl]furo[2,3-c]pyridine-5-carboxamide;dihydrochloride IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]furo[2,3-c]pyridine-5-carboxamide;dihydrochloride IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]furo[2,3-c]pyridine-5-carboxamide;dihydrochloride IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N-[(3R)-quinuclidin-3-yl]furo[2,3-c]pyridine-5-carboxamide;dihydrochloride InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C15H17N3O2.2ClH/c19-15(12-7-11-3-6-20-14(11)8-16-12)17-13-9-18-4-1-10(13)2-5-18;;/h3,6-8,10,13H,1-2,4-5,9H2,(H,17,19);2*1H/t13-;;/m0../s1 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 USJDQOUQSDDWPO-GXKRWWSZSA-N Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 343.0854322 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C15H19Cl2N3O2 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 344.2 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1CN2CCC1C(C2)NC(=O)C3=NC=C4C(=C3)C=CO4.Cl.Cl SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1CN2CCC1[C@H](C2)NC(=O)C3=NC=C4C(=C3)C=CO4.Cl.Cl Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 58.4 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 343.0854322 22 1 1 0 0 0 0 0 3 -1