88675 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 7 7 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 2 2 2 3 3 3 4 5 6 6 7 7 8 8 9 9 10 10 11 12 13 13 13 14 14 14 15 15 15 16 16 16 4 13 14 5 15 16 4 5 6 7 8 9 10 11 17 12 18 11 19 12 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 1 1 1 1 1 1 1 1 2 2 2 1 1 1 1 1 1 2 1 2 1 1 1 1 1 1 1 1 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 23 24 25 26 27 28 29 30 31 32 33 34 6.0215 2.9849 4.4936 5.3876 3.6276 4.4936 6.2936 2.7616 5.3876 3.6276 6.2936 2.7616 7.0082 5.6686 2 3.3268 6.8294 2.2246 5.3804 3.6276 6.8294 2.2246 7.1088 7.62 6.9076 5.0885 5.4498 6.2487 2.1077 1.3894 1.8923 2.7442 3.5388 3.9094 -0.9535 -0.9116 0.3545 -0.1801 -0.1455 1.3546 0.3337 0.3545 1.8892 1.8546 1.3754 1.3546 -0.7913 -1.8892 -0.7379 -1.8512 0.0217 0.0445 2.5092 2.4745 1.6874 1.6646 -1.4031 -0.6907 -0.1795 -1.6704 -2.4693 -2.108 -0.1273 -0.6302 -1.3485 -2.0632 -2.4338 -1.6392 8 8 8 8 8 8 8 8 8 8 8 3 3 3 4 5 6 6 7 8 9 10 4 5 6 7 8 9 10 11 12 11 12 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 203 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 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 00000371E0730000000000000000000000000000000000000000306000000000000000C15000001C00000000000C0881180432C0C3000000800224424000820000210200088800086488082022C0D1D184200860800048C8071080800E80000040001200000000008000240000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N1,N1,N8,N8-tetramethylnaphthalene-1,8-diamine IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N1,N1,N8,N8-tetramethylnaphthalene-1,8-diamine IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 1-<I>N</I>,1-<I>N</I>,8-<I>N</I>,8-<I>N</I>-tetramethylnaphthalene-1,8-diamine IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 1-N,1-N,8-N,8-N-tetramethylnaphthalene-1,8-diamine IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 N1,N1,N8,N8-tetramethylnaphthalene-1,8-diamine IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [8-(dimethylamino)-1-naphthyl]-dimethyl-amine InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C14H18N2/c1-15(2)12-9-5-7-11-8-6-10-13(14(11)12)16(3)4/h5-10H,1-4H3 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 GJFNRSDCSTVPCJ-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 3.4 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 214.146998583 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C14H18N2 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 214.31 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 CN(C)C1=CC=CC2=C1C(=CC=C2)N(C)C SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 CN(C)C1=CC=CC2=C1C(=CC=C2)N(C)C Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 6.5 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 214.146998583 16 0 0 0 0 0 0 0 1 -1