[6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane

C32H37GeN2+ — CID 166030473

About [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane

[6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane (PubChem CID 166030473) has the molecular formula C32H37GeN2+ and a molecular weight of 522.27 g/mol. Its IUPAC name is [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane.

Molecular Properties

• Compound Name: [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane
• PubChem CID: 166030473
• Molecular Formula: C32H37GeN2+
• Molecular Weight: 522.27 g/mol
• Exact Mass: 523.22
• IUPAC Name: [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane
• SMILES: Cc1cc2c3c(CC(C)(C)C)cccc3n3c4cc([Ge](C)(C)C)cc5cc[n+](C)c(c(c1C)c23)c54
• InChI: InChI=1S/C32H37GeN2/c1-19-15-24-28-22(18-32(3,4)5)11-10-12-25(28)35-26-17-23(33(6,7)8)16-21-13-14-34(9)31(29(21)26)27(20(19)2)30(24)35/h10-17H,18H2,1-9H3/q+1
• InChIKey: OWKHVKDYCHYZBB-UHFFFAOYSA-N
• XLogP: 7.57
• TPSA: 8.29 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 2
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	522.27
LogP ≤ 5	7.57
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

• Structural Alerts: {'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 [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane?

The IUPAC name of [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane (CID 166030473) is [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane.

What is the SMILES notation for [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane?

The canonical SMILES for [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane is Cc1cc2c3c(CC(C)(C)C)cccc3n3c4cc([Ge](C)(C)C)cc5cc[n+](C)c(c(c1C)c23)c54.

What is the InChIKey of [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane?

The InChIKey is OWKHVKDYCHYZBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H37GeN2/c1-19-15-24-28-22(18-32(3,4)5)11-10-12-25(28)35-26-17-23(33(6,7)8)16-21-13-14-34(9)31(29(21)26)27(20(19)2)30(24)35/h10-17H,18H2,1-9H3/q+1.

What are the key properties of [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane?

[6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane has a molecular weight of 522.27 g/mol, XLogP of 7.57, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for [6-(2,2-dimethylpropyl)-10,11,14-trimethyl-1-aza-14-azoniahexacyclo[10.9.1.113,17.02,7.08,22.021,23]tricosa-2,4,6,8(22),9,11,13,15,17,19,21(23)-undecaen-19-yl]-trimethylgermane is sourced from PubChem (CID 166030473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).