7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine

C69H66N2Si2 — CID 140962161

About 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine

7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine (PubChem CID 140962161) has the molecular formula C69H66N2Si2 and a molecular weight of 979.47 g/mol. Its IUPAC name is 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine.

Molecular Properties

• Compound Name: 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine
• PubChem CID: 140962161
• Molecular Formula: C69H66N2Si2
• Molecular Weight: 979.47 g/mol
• Exact Mass: 978.48
• IUPAC Name: 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine
• SMILES: CC(C)c1ccc(N(c2ccc([Si](C)(C)C)cc2)c2ccc3cc4c(cc3c2)C2(c3ccccc3-c3ccccc32)c2c-4ccc3cc(N(c4ccc(C(C)C)cc4)c4ccc([Si](C)(C)C)cc4)ccc23)cc1
• InChI: InChI=1S/C69H66N2Si2/c1-45(2)47-19-25-52(26-20-47)70(54-30-35-58(36-31-54)72(5,6)7)56-29-23-49-43-64-63-39-24-50-41-57(71(53-27-21-48(22-28-53)46(3)4)55-32-37-59(38-33-55)73(8,9)10)34-40-60(50)68(63)69(67(64)44-51(49)42-56)65-17-13-11-15-61(65)62-16-12-14-18-66(62)69/h11-46H,1-10H3
• InChIKey: NQPGKGGMKFVQAR-UHFFFAOYSA-N
• XLogP: 18.61
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 10
• Heavy Atoms: 73
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	979.47
LogP ≤ 5	18.61
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine?

The IUPAC name of 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine (CID 140962161) is 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine.

What is the SMILES notation for 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine?

The canonical SMILES for 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine is CC(C)c1ccc(N(c2ccc([Si](C)(C)C)cc2)c2ccc3cc4c(cc3c2)C2(c3ccccc3-c3ccccc32)c2c-4ccc3cc(N(c4ccc(C(C)C)cc4)c4ccc([Si](C)(C)C)cc4)ccc23)cc1.

What is the InChIKey of 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine?

The InChIKey is NQPGKGGMKFVQAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H66N2Si2/c1-45(2)47-19-25-52(26-20-47)70(54-30-35-58(36-31-54)72(5,6)7)56-29-23-49-43-64-63-39-24-50-41-57(71(53-27-21-48(22-28-53)46(3)4)55-32-37-59(38-33-55)73(8,9)10)34-40-60(50)68(63)69(67(64)44-51(49)42-56)65-17-13-11-15-61(65)62-16-12-14-18-66(62)69/h11-46H,1-10H3.

What are the key properties of 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine?

7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine has a molecular weight of 979.47 g/mol, XLogP of 18.61, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 7-N',17-N'-bis(4-propan-2-ylphenyl)-7-N',17-N'-bis(4-trimethylsilylphenyl)spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine is sourced from PubChem (CID 140962161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).