N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline

C114H72N4 — CID 158220766

About N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline

N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline (PubChem CID 158220766) has the molecular formula C114H72N4 and a molecular weight of 1497.86 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline.

Molecular Properties

• Compound Name: N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline
• PubChem CID: 158220766
• Molecular Formula: C114H72N4
• Molecular Weight: 1497.86 g/mol
• Exact Mass: 1496.58
• IUPAC Name: N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline
• SMILES: c1ccc(-c2ccc(N(c3ccc(-c4ccc5c6c(cccc46)C54c5cccc6cccc4c56)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5c6c(cccc46)C54c5cccc6cccc4c56)cc3)cc2)cc1
• InChI: InChI=1S/2C57H36N2/c1-3-12-37(13-4-1)40-26-35-54-48(36-40)46-18-7-8-23-53(46)59(54)44-31-29-43(30-32-44)58(41-16-5-2-6-17-41)42-27-24-38(25-28-42)45-33-34-52-56-47(45)19-11-22-51(56)57(52)49-20-9-14-39-15-10-21-50(57)55(39)49;1-2-11-37(12-3-1)38-23-27-41(28-24-38)58(43-31-33-44(34-32-43)59-53-21-6-4-15-46(53)47-16-5-7-22-54(47)59)42-29-25-39(26-30-42)45-35-36-52-56-48(45)17-10-20-51(56)57(52)49-18-8-13-40-14-9-19-50(57)55(40)49/h2*1-36H
• InChIKey: GDFHBJLWCYPYEC-UHFFFAOYSA-N
• XLogP: 29.81
• TPSA: 16.34 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 12
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1497.86
LogP ≤ 5	29.81
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline?

The IUPAC name of N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline (CID 158220766) is N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline.

What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline?

The canonical SMILES for N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline is c1ccc(-c2ccc(N(c3ccc(-c4ccc5c6c(cccc46)C54c5cccc6cccc4c56)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5c6c(cccc46)C54c5cccc6cccc4c56)cc3)cc2)cc1.

What is the InChIKey of N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline?

The InChIKey is GDFHBJLWCYPYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C57H36N2/c1-3-12-37(13-4-1)40-26-35-54-48(36-40)46-18-7-8-23-53(46)59(54)44-31-29-43(30-32-44)58(41-16-5-2-6-17-41)42-27-24-38(25-28-42)45-33-34-52-56-47(45)19-11-22-51(56)57(52)49-20-9-14-39-15-10-21-50(57)55(39)49;1-2-11-37(12-3-1)38-23-27-41(28-24-38)58(43-31-33-44(34-32-43)59-53-21-6-4-15-46(53)47-16-5-7-22-54(47)59)42-29-25-39(26-30-42)45-35-36-52-56-48(45)17-10-20-51(56)57(52)49-18-8-13-40-14-9-19-50(57)55(40)49/h2*1-36H.

What are the key properties of N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline?

N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline has a molecular weight of 1497.86 g/mol, XLogP of 29.81, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-carbazol-9-ylphenyl)-4-phenyl-N-(4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylphenyl)aniline;N-phenyl-N-[4-(3-phenylcarbazol-9-yl)phenyl]-4-spiro[tricyclo[5.3.1.03,11]undeca-1(10),3(11),4,6,8-pentaene-2,2'-tricyclo[5.3.1.03,11]undeca-1(10),3,5,7(11),8-pentaene]-6-ylaniline is sourced from PubChem (CID 158220766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).