7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine

C71H62N2Si — CID 162125263

About 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine

7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine (PubChem CID 162125263) has the molecular formula C71H62N2Si and a molecular weight of 971.38 g/mol. Its IUPAC name is 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine.

Molecular Properties

• Compound Name: 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine
• PubChem CID: 162125263
• Molecular Formula: C71H62N2Si
• Molecular Weight: 971.38 g/mol
• Exact Mass: 970.47
• IUPAC Name: 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine
• SMILES: Cc1ccc(N(c2ccc(C(C)C)cc2)c2ccc3c4c(ccc3c2)-c2ccc3cc(N(c5ccc(C(C)C)cc5)c5ccc([Si](C)(C)C)cc5)ccc3c2C42c3ccccc3-c3c2ccc2ccccc32)cc1
• InChI: InChI=1S/C71H62N2Si/c1-45(2)48-19-28-54(29-20-48)72(53-26-17-47(5)18-27-53)57-34-40-61-51(43-57)23-38-63-64-39-24-52-44-58(73(55-30-21-49(22-31-55)46(3)4)56-32-36-59(37-33-56)74(6,7)8)35-41-62(52)70(64)71(69(61)63)66-16-12-11-15-65(66)68-60-14-10-9-13-50(60)25-42-67(68)71/h9-46H,1-8H3
• InChIKey: GUKUSULSEIRCRE-UHFFFAOYSA-N
• XLogP: 19.53
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 9
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	971.38
LogP ≤ 5	19.53
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'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine?

The IUPAC name of 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine (CID 162125263) is 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine.

What is the SMILES notation for 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine?

The canonical SMILES for 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine is Cc1ccc(N(c2ccc(C(C)C)cc2)c2ccc3c4c(ccc3c2)-c2ccc3cc(N(c5ccc(C(C)C)cc5)c5ccc([Si](C)(C)C)cc5)ccc3c2C42c3ccccc3-c3c2ccc2ccccc32)cc1.

What is the InChIKey of 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine?

The InChIKey is GUKUSULSEIRCRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H62N2Si/c1-45(2)48-19-28-54(29-20-48)72(53-26-17-47(5)18-27-53)57-34-40-61-51(43-57)23-38-63-64-39-24-52-44-58(73(55-30-21-49(22-31-55)46(3)4)56-32-36-59(37-33-56)74(6,7)8)35-41-62(52)70(64)71(69(61)63)66-16-12-11-15-65(66)68-60-14-10-9-13-50(60)25-42-67(68)71/h9-46H,1-8H3.

What are the key properties of 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine?

7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine has a molecular weight of 971.38 g/mol, XLogP of 19.53, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 7-N'-(4-methylphenyl)-7-N',17-N'-bis(4-propan-2-ylphenyl)-17-N'-(4-trimethylsilylphenyl)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14(19),15,17,20-decaene]-7',17'-diamine is sourced from PubChem (CID 162125263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).