10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene

C124H153N10O5Si5+5 — CID 158055156

IUPAC10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene
SMILESCc1ccc2c3c1c1cccc(C(C)C)c1c1n(C(C)C)c(C)c([n+]31)[Si](C)(C)O2.[2H]C([2H])([2H])[Si]1(C)Oc2ccc(C)c3c4cccc(C(C)C)c4c4n(C(C)C)c(C)c1[n+]4c23.[2H]C([2H])([2H])[Si]1(C)Oc2cccc3c4cccc(C(C)C)c4c4n(C(C)C)c(C)c1[n+]4c23.[2H]C([2H])([2H])c1ccc2c3c1c1cccc(C(C)C)c1c1n(C(C)C)c(C)c([n+]31)[Si](C)(C([2H])([2H])[2H])O2.[2H]C([2H])([2H])c1ccc2c3c1c1cccc(C(C)C)c1c1n(C(C)C)c(C)c([n+]31)[Si](C)(C)O2
InChIInChI=1S/4C25H31N2OSi.C24H29N2OSi/c4*1-14(2)18-10-9-11-19-21-16(5)12-13-20-23(21)27-24(22(18)19)26(15(3)4)17(6)25(27)29(7,8)28-20;1-14(2)17-10-8-11-18-19-12-9-13-20-22(19)26-23(21(17)18)25(15(3)4)16(5)24(26)28(6,7)27-20/h4*9-15H,1-8H3;8-15H,1-7H3/q5*+1/i5D3,7D3;7D3;5D3;;6D3
InChIKeyNAZSEKZHHFDHRM-IEYKEQSRSA-N
MW2019.17 g/mol
LogP27.99
Rot. Bonds15

About 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene

10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene (PubChem CID 158055156) has the molecular formula C124H153N10O5Si5+5 and a molecular weight of 2019.17 g/mol. Its IUPAC name is 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene.

Molecular Properties

Compound Name10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene
PubChem CID158055156
Molecular FormulaC124H153N10O5Si5+5
Molecular Weight2019.17 g/mol
Exact Mass2017.18
IUPAC Name10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene
SMILESCc1ccc2c3c1c1cccc(C(C)C)c1c1n(C(C)C)c(C)c([n+]31)[Si](C)(C)O2.[2H]C([2H])([2H])[Si]1(C)Oc2ccc(C)c3c4cccc(C(C)C)c4c4n(C(C)C)c(C)c1[n+]4c23.[2H]C([2H])([2H])[Si]1(C)Oc2cccc3c4cccc(C(C)C)c4c4n(C(C)C)c(C)c1[n+]4c23.[2H]C([2H])([2H])c1ccc2c3c1c1cccc(C(C)C)c1c1n(C(C)C)c(C)c([n+]31)[Si](C)(C([2H])([2H])[2H])O2.[2H]C([2H])([2H])c1ccc2c3c1c1cccc(C(C)C)c1c1n(C(C)C)c(C)c([n+]31)[Si](C)(C)O2
InChIInChI=1S/4C25H31N2OSi.C24H29N2OSi/c4*1-14(2)18-10-9-11-19-21-16(5)12-13-20-23(21)27-24(22(18)19)26(15(3)4)17(6)25(27)29(7,8)28-20;1-14(2)17-10-8-11-18-19-12-9-13-20-22(19)26-23(21(17)18)25(15(3)4)16(5)24(26)28(6,7)27-20/h4*9-15H,1-8H3;8-15H,1-7H3/q5*+1/i5D3,7D3;7D3;5D3;;6D3
InChIKeyNAZSEKZHHFDHRM-IEYKEQSRSA-N
XLogP27.99
TPSA91.30 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds15
Heavy Atoms144
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002019.17
LogP ≤ 527.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 157078464
CID 157078464
2-[2-Carbazol-9-id-1-yl-1-(3,5-dimethylphenyl)benzimidazol-4-yl]-4-(3,5-dimethylphenyl)quinolin-8-ol;2-[2-carbazol-9-id-1-yl-1-(3-phenylphenyl)benzimidazol-4-yl]-4-(3,5-dimethylphenyl)quinolin-8-ol;2-(2-carbazol-9-id-1-yl-1-propan-2-ylbenzimidazol-4-yl)-4-phenylquinolin-8-ol;2-(2-carbazol-9-id-1-yl-1-propan-2-ylbenzimidazol-4-yl)quinolin-8-ol;platinum
CID 157143908
11-Methyl-10-aza-1-azoniahexacyclo[10.9.0.02,10.03,8.04,20.016,21]henicosa-1,3(8),4,6,11,16(21),17,19-octaene;11-methyl-13,13-diphenyl-14-oxa-10-aza-1-azonia-13-silahexacyclo[10.8.0.02,10.03,8.04,19.015,20]icosa-1,3(8),4,6,11,15,17,19-octaene;11-methyl-14,14-diphenyl-13-oxa-10-aza-1-azonia-14-silahexacyclo[10.8.0.02,10.03,8.04,19.015,20]icosa-1,3(8),4,6,11,15,17,19-octaene;11-methyl-17-propan-2-yl-10-aza-1-azoniahexacyclo[10.8.0.02,10.03,8.04,19.015,20]icosa-1,3(8),4,6,11,15(20),16,18-octaene;11,13,13-trimethyl-14-oxa-10-aza-1-azonia-13-silahexacyclo[10.8.0.02,10.03,8.04,19.015,20]icosa-1,3(8),4,6,11,15,17,19-octaene;11,14,14-trimethyl-13-oxa-10-aza-1-azonia-14-silahexacyclo[10.8.0.02,10.03,8.04,19.015,20]icosa-1,3(8),4,6,11,15,17,19-octaene
CID 157263376
Tetralithium;5-[10-(8-oxidoquinolin-1-ium-5-yl)-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate;5-[2-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate;5-[3-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate
CID 157310278
Pentalithium;5-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate;7-[2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate;7-[10-(1-phenylbenzimidazol-2-yl)anthracen-9-yl]quinolin-1-ium-8-olate;5-[10-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate;7-[10-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate
CID 157322061
10,13,13,17-Tetramethyl-12,12-diphenyl-6,9-di(propan-2-yl)-9-aza-19-azonia-13-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,13,13-tetramethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-9-aza-19-azonia-13-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,13,13-trimethyl-12,12-diphenyl-6,9-di(propan-2-yl)-9-aza-19-azonia-13-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,13,13-trimethyl-12,12-diphenyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-9-aza-19-azonia-13-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene
CID 157343364
2-[2-(5-Tert-butylindol-1-id-7-yl)-1-(3,5-dimethylphenyl)benzimidazol-4-yl]quinolin-8-ol;2-[2-(5-tert-butylindol-1-id-7-yl)-1-phenylbenzimidazol-4-yl]-4-(3,5-dimethylphenyl)quinolin-8-ol;2-[2-(5-tert-butylindol-1-id-7-yl)-1-phenylbenzimidazol-4-yl]-4-phenylquinolin-8-ol;2-[2-(5-tert-butylindol-1-id-7-yl)-1-phenylbenzimidazol-4-yl]quinolin-8-ol;2-[2-(5-tert-butylindol-1-id-7-yl)-1-(3-phenylphenyl)benzimidazol-4-yl]quinolin-8-ol;ethane;platinum
CID 157417015
CID 157429930
CID 157429930
Hexalithium;5-[10-(8-oxidoquinolin-1-ium-5-yl)-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate;7-[10-(8-oxidoquinolin-1-ium-7-yl)-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate;5-[2-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate;5-[3-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-1-ium-8-olate
CID 157567579
2-[3,5-bis(1-phenylbenzimidazol-2-yl)phenyl]-1-phenylbenzimidazole;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;bis(iridium);2-methyl-4-[3-methyl-4-(3-methyl-N-(3-methylphenyl)anilino)phenyl]-N,N-bis(3-methylphenyl)aniline;2-phenylpyridine;triphenyl-(4-triphenylsilylphenyl)silane;tri(quinolin-8-yloxy)alumane
CID 157568688
16-(2,6-Dimethylphenyl)-17-methyl-9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(18),2,4,6,8,10,14,16-octaene;17-methyl-12,12-diphenyl-9,19-diaza-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene;17-methyl-13,13-diphenyl-9,19-diaza-13-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene;17-methyl-13-oxa-9,19-diazapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene;12,12,17-trimethyl-9,19-diaza-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene;13,13,17-trimethyl-9,19-diaza-13-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2,4,6,8,10,14(18),15-octaene
CID 157613306
2-[1-(3,5-Dimethylphenyl)-2-indol-1-id-7-ylbenzimidazol-4-yl]-4-phenylquinolin-8-ol;4-(3,5-dimethylphenyl)-2-(2-indol-1-id-7-yl-1-phenylbenzimidazol-4-yl)quinolin-8-ol;2-(2-indol-1-id-7-yl-1-methylbenzimidazol-4-yl)-4-phenylquinolin-8-ol;2-(2-indol-1-id-7-yl-1-methylbenzimidazol-4-yl)quinolin-8-ol;2-[2-indol-1-id-7-yl-1-(3-phenylphenyl)benzimidazol-4-yl]-4-phenylquinolin-8-ol;platinum
CID 157654053

Frequently Asked Questions

What is the IUPAC name of 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene?
The IUPAC name of 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene (CID 158055156) is 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene.
What is the SMILES notation for 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene?
The canonical SMILES for 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene is Cc1ccc2c3c1c1cccc(C(C)C)c1c1n(C(C)C)c(C)c([n+]31)[Si](C)(C)O2.[2H]C([2H])([2H])[Si]1(C)Oc2ccc(C)c3c4cccc(C(C)C)c4c4n(C(C)C)c(C)c1[n+]4c23.[2H]C([2H])([2H])[Si]1(C)Oc2cccc3c4cccc(C(C)C)c4c4n(C(C)C)c(C)c1[n+]4c23.[2H]C([2H])([2H])c1ccc2c3c1c1cccc(C(C)C)c1c1n(C(C)C)c(C)c([n+]31)[Si](C)(C([2H])([2H])[2H])O2.[2H]C([2H])([2H])c1ccc2c3c1c1cccc(C(C)C)c1c1n(C(C)C)c(C)c([n+]31)[Si](C)(C)O2.
What is the InChIKey of 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene?
The InChIKey is NAZSEKZHHFDHRM-IEYKEQSRSA-N. The full InChI is InChI=1S/4C25H31N2OSi.C24H29N2OSi/c4*1-14(2)18-10-9-11-19-21-16(5)12-13-20-23(21)27-24(22(18)19)26(15(3)4)17(6)25(27)29(7,8)28-20;1-14(2)17-10-8-11-18-19-12-9-13-20-22(19)26-23(21(17)18)25(15(3)4)16(5)24(26)28(6,7)27-20/h4*9-15H,1-8H3;8-15H,1-7H3/q5*+1/i5D3,7D3;7D3;5D3;;6D3.
What are the key properties of 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene?
10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene has a molecular weight of 2019.17 g/mol, XLogP of 27.99, 15 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 10,12-dimethyl-6,9-di(propan-2-yl)-12,17-bis(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12-dimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1,3,5,7,10,14,16,18-octaene;10,12,12,17-tetramethyl-6,9-di(propan-2-yl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,12-trimethyl-6,9-di(propan-2-yl)-17-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene;10,12,17-trimethyl-6,9-di(propan-2-yl)-12-(trideuteriomethyl)-13-oxa-9-aza-19-azonia-12-silapentacyclo[9.6.2.02,7.08,19.014,18]nonadeca-1(17),2(7),3,5,8(19),10,14(18),15-octaene is sourced from PubChem (CID 158055156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).