About 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene
1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene (PubChem CID 159572328) has the molecular formula C132H163N39O7
and a molecular weight of 2408.02 g/mol. Its IUPAC name is 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene.
Frequently Asked Questions
What is the IUPAC name of 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene?
The IUPAC name of 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene (CID 159572328) is 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene.
What is the SMILES notation for 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene?
The canonical SMILES for 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene is C1N=NC(c2n[nH]c3c2CC2CC32)=N1.CC(=O)c1n[nH]c2c1C1CC1C2.CC(=O)c1n[nH]c2c1CC1C(C)C21.CC(=O)c1n[nH]c2c1CC1C(CC(C)C)C21.CC(=O)c1n[nH]c2c1CC1C2C1(C)C.CC(=O)c1n[nH]c2c1CC1CC21.CC1(C)C2Cc3c(C4=NCN=N4)n[nH]c3C21.CC1C2Cc3c(C4=NCN=N4)n[nH]c3C12.CCC1C2Cc3c(C4=NCN=N4)n[nH]c3C12.CCCC1C2Cc3c(C4=NCN=N4)n[nH]c3C12.CCCCC1C2Cc3c(C(C)=O)n[nH]c3C12.CCCCCC1C2Cc3c(C(C)=O)n[nH]c3C12.
What is the InChIKey of 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene?
The InChIKey is MHZCBVARELJZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O.2C13H18N2O.C12H15N5.2C11H13N5.C11H14N2O.C10H11N5.C10H12N2O.C9H9N5.2C9H10N2O/c1-3-4-5-6-9-10-7-11-13(8(2)17)15-16-14(11)12(9)10;1-6(2)4-8-9-5-10-12(7(3)16)14-15-13(10)11(8)9;1-3-4-5-8-9-6-10-12(7(2)16)14-15-13(10)11(8)9;1-2-3-6-7-4-8-10(9(6)7)15-16-11(8)12-13-5-14-17-12;1-11(2)6-3-5-8(7(6)11)14-15-9(5)10-12-4-13-16-10;1-2-5-6-3-7-9(8(5)6)14-15-10(7)11-12-4-13-16-11;1-5(14)9-6-4-7-8(11(7,2)3)10(6)13-12-9;1-4-5-2-6-8(7(4)5)13-14-9(6)10-11-3-12-15-10;1-4-6-3-7-9(5(2)13)11-12-10(7)8(4)6;1-4-2-6-7(5(1)4)12-13-8(6)9-10-3-11-14-9;1-4(12)9-8-6-2-5(6)3-7(8)10-11-9;1-4(12)8-7-3-5-2-6(5)9(7)11-10-8/h9-10,12H,3-7H2,1-2H3,(H,15,16);6,8-9,11H,4-5H2,1-3H3,(H,14,15);8-9,11H,3-6H2,1-2H3,(H,14,15);6-7,9H,2-5H2,1H3,(H,15,16);6-7H,3-4H2,1-2H3,(H,14,15);5-6,8H,2-4H2,1H3,(H,14,15);7-8H,4H2,1-3H3,(H,12,13);4-5,7H,2-3H2,1H3,(H,13,14);4,6,8H,3H2,1-2H3,(H,11,12);4-5H,1-3H2,(H,12,13);2*5-6H,2-3H2,1H3,(H,10,11).
What are the key properties of 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene?
1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene has a molecular weight of 2408.02 g/mol, XLogP of 23.02, 24 rotatable bonds, 12 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-butyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-9-yl)ethanone;1-(8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-(3,3-dimethyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3,3-dimethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;3-ethyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-methyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;1-[3-(2-methylpropyl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl]ethanone;3-methyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;1-(3-pentyl-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-dien-7-yl)ethanone;3-propyl-7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene;7-(3H-1,2,4-triazol-5-yl)-8,9-diazatricyclo[4.3.0.02,4]nona-1(6),7-diene is sourced from PubChem (CID 159572328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).