trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane

C23H25N2OSi+ — CID 164722638

About trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane

trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane (PubChem CID 164722638) has the molecular formula C23H25N2OSi+ and a molecular weight of 373.55 g/mol. Its IUPAC name is trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane.

Molecular Properties

• Compound Name: trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane
• PubChem CID: 164722638
• Molecular Formula: C23H25N2OSi+
• Molecular Weight: 373.55 g/mol
• Exact Mass: 373.17
• IUPAC Name: trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane
• SMILES: Cc1c2c(cc3occc13)N(C)c1cc([Si](C)(C)C)cc3cc[n+](C)c-2c13
• InChI: InChI=1S/C23H25N2OSi/c1-14-17-8-10-26-20(17)13-19-21(14)23-22-15(7-9-24(23)2)11-16(27(4,5)6)12-18(22)25(19)3/h7-13H,1-6H3/q+1
• InChIKey: WCSSNYPUYSQNRU-UHFFFAOYSA-N
• XLogP: 5.01
• TPSA: 20.26 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 1
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	373.55
LogP ≤ 5	5.01
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-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane?

The IUPAC name of trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane (CID 164722638) is trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane.

What is the SMILES notation for trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane?

The canonical SMILES for trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane is Cc1c2c(cc3occc13)N(C)c1cc([Si](C)(C)C)cc3cc[n+](C)c-2c13.

What is the InChIKey of trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane?

The InChIKey is WCSSNYPUYSQNRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N2OSi/c1-14-17-8-10-26-20(17)13-19-21(14)23-22-15(7-9-24(23)2)11-16(27(4,5)6)12-18(22)25(19)3/h7-13H,1-6H3/q+1.

What are the key properties of trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane?

trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane has a molecular weight of 373.55 g/mol, XLogP of 5.01, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for trimethyl-(3,11,19-trimethyl-7-oxa-11-aza-19-azoniapentacyclo[10.7.1.02,10.04,8.016,20]icosa-1(19),2,4(8),5,9,12(20),13,15,17-nonaen-14-yl)silane is sourced from PubChem (CID 164722638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).