52012102 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 9 8 7 7 7 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 2 3 3 3 4 4 4 5 6 6 6 6 7 7 8 8 9 9 10 10 11 13 13 14 14 15 15 16 16 17 17 18 19 19 20 20 21 12 5 9 16 7 12 26 10 7 8 22 23 24 25 13 14 11 15 11 12 27 19 28 20 29 17 30 18 31 18 32 33 21 34 21 35 1 2 1 1 1 1 1 1 2 1 1 1 1 1 1 2 1 2 1 1 1 1 1 1 2 1 2 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 12.2619 6.7619 3.732 6.7619 4.6783 8.2619 7.7619 9.2619 3.732 5.2619 4.6783 6.2619 9.7619 9.7619 2.866 2.866 2 2 10.7619 10.7619 11.2619 7.6793 8.3695 8.3445 7.6542 6.4519 4.8709 9.4519 9.4519 2.866 2.866 1.4631 1.4631 11.0719 11.0719 -0.933 1.6651 0.299 -0.067 -0.0057 -0.933 -0.067 -0.933 1.299 0.799 1.6038 0.799 -0.067 -1.799 1.799 -0.201 1.299 0.299 -0.067 -1.799 -0.933 -1.1451 -1.5436 0.1451 0.5436 -0.6039 2.1931 0.4699 -2.336 2.419 -0.821 1.609 -0.011 0.4699 -2.336 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 3 3 3 5 8 8 9 9 10 13 14 15 16 17 19 20 5 9 16 10 13 14 11 15 11 19 20 17 18 18 21 21 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 357 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 3 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 4 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 00000371C07B21000000000000000000000000000001600000003C400000000000005801F000001F00180000000C08C19E0C3CC0B2C81000AA033577540092842037822018D8A1B864D80860F2C0D5D194A508609E00C8C9871C88808E00000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-[2-(4-fluorophenyl)ethyl]pyrazolo[1,5-a]pyridine-2-carboxamide IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-[2-(4-fluorophenyl)ethyl]-2-pyrazolo[1,5-a]pyridinecarboxamide IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 <I>N</I>-[2-(4-fluorophenyl)ethyl]pyrazolo[1,5-a]pyridine-2-carboxamide IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-[2-(4-fluorophenyl)ethyl]pyrazolo[1,5-a]pyridine-2-carboxamide IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-[2-(4-fluorophenyl)ethyl]pyrazolo[1,5-a]pyridine-2-carboxamide IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.05.07 N-[2-(4-fluorophenyl)ethyl]pyrazolo[1,5-a]pyridine-2-carboxamide InChI Standard 1 1.0.6 InChI iupac.org 2021.05.07 InChI=1S/C16H14FN3O/c17-13-6-4-12(5-7-13)8-9-18-16(21)15-11-14-3-1-2-10-20(14)19-15/h1-7,10-11H,8-9H2,(H,18,21) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.05.07 DIRZWIQMMNDFDB-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.05.07 2.7 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 283.11209024 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 C16H14FN3O Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 283.30 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1=CC2=CC(=NN2C=C1)C(=O)NCCC3=CC=C(C=C3)F SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.05.07 C1=CC2=CC(=NN2C=C1)C(=O)NCCC3=CC=C(C=C3)F Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.05.07 46.4 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 283.11209024 21 0 0 0 0 0 0 0 1 -1