trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane

C24H26NO2Si+ — CID 166054083

About trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane

trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane (PubChem CID 166054083) has the molecular formula C24H26NO2Si+ and a molecular weight of 388.56 g/mol. Its IUPAC name is trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane.

Molecular Properties

• Compound Name: trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane
• PubChem CID: 166054083
• Molecular Formula: C24H26NO2Si+
• Molecular Weight: 388.56 g/mol
• Exact Mass: 388.17
• IUPAC Name: trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane
• SMILES: Cc1cc2c3c(c(C)c(C)cc3c1)-c1c(c3cc([Si](C)(C)C)oc3c[n+]1C)O2
• InChI: InChI=1S/C24H26NO2Si/c1-13-8-16-10-14(2)15(3)21-22(16)18(9-13)27-24-17-11-20(28(5,6)7)26-19(17)12-25(4)23(21)24/h8-12H,1-7H3/q+1
• InChIKey: QDQSTLVEAXHZPQ-UHFFFAOYSA-N
• XLogP: 5.65
• TPSA: 26.25 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 1
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	388.56
LogP ≤ 5	5.65
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane?

The IUPAC name of trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane (CID 166054083) is trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane.

What is the SMILES notation for trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane?

The canonical SMILES for trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane is Cc1cc2c3c(c(C)c(C)cc3c1)-c1c(c3cc([Si](C)(C)C)oc3c[n+]1C)O2.

What is the InChIKey of trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane?

The InChIKey is QDQSTLVEAXHZPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26NO2Si/c1-13-8-16-10-14(2)15(3)21-22(16)18(9-13)27-24-17-11-20(28(5,6)7)26-19(17)12-25(4)23(21)24/h8-12H,1-7H3/q+1.

What are the key properties of trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane?

trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane has a molecular weight of 388.56 g/mol, XLogP of 5.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for trimethyl-(3,14,18,19-tetramethyl-6,11-dioxa-3-azoniapentacyclo[10.7.1.02,10.05,9.016,20]icosa-1(19),2,4,7,9,12,14,16(20),17-nonaen-7-yl)silane is sourced from PubChem (CID 166054083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).