trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane

C26H26N3Si+ — CID 166030020

About trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane

trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane (PubChem CID 166030020) has the molecular formula C26H26N3Si+ and a molecular weight of 408.60 g/mol. Its IUPAC name is trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane.

Molecular Properties

• Compound Name: trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane
• PubChem CID: 166030020
• Molecular Formula: C26H26N3Si+
• Molecular Weight: 408.60 g/mol
• Exact Mass: 408.19
• IUPAC Name: trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane
• SMILES: Cc1cc2c3cccnc3n3c4c([Si](C)(C)C)ccc5cc[n+](C)c(c(c1C)c23)c54
• InChI: InChI=1S/C26H26N3Si/c1-15-14-19-18-8-7-12-27-26(18)29-23(19)21(16(15)2)25-22-17(11-13-28(25)3)9-10-20(24(22)29)30(4,5)6/h7-14H,1-6H3/q+1
• InChIKey: UNSQODPDLSFQBL-UHFFFAOYSA-N
• XLogP: 5.37
• TPSA: 21.18 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 1
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	408.60
LogP ≤ 5	5.37
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane?

The IUPAC name of trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane (CID 166030020) is trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane.

What is the SMILES notation for trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane?

The canonical SMILES for trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane is Cc1cc2c3cccnc3n3c4c([Si](C)(C)C)ccc5cc[n+](C)c(c(c1C)c23)c54.

What is the InChIKey of trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane?

The InChIKey is UNSQODPDLSFQBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N3Si/c1-15-14-19-18-8-7-12-27-26(18)29-23(19)21(16(15)2)25-22-17(11-13-28(25)3)9-10-20(24(22)29)30(4,5)6/h7-14H,1-6H3/q+1.

What are the key properties of trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane?

trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane has a molecular weight of 408.60 g/mol, XLogP of 5.37, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for trimethyl-(10,11,14-trimethyl-1,3-diaza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2(7),3,5,8(22),9,11,13,15,17(23),18,20-undecaen-20-yl)silane is sourced from PubChem (CID 166030020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).