N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine

C65H42N2 — CID 135167243

About N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine

N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine (PubChem CID 135167243) has the molecular formula C65H42N2 and a molecular weight of 851.07 g/mol. Its IUPAC name is N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine.

Molecular Properties

• Compound Name: N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine
• PubChem CID: 135167243
• Molecular Formula: C65H42N2
• Molecular Weight: 851.07 g/mol
• Exact Mass: 850.33
• IUPAC Name: N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine
• SMILES: c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cccc5c6ccccc6n-4c35)cc2)cc1
• InChI: InChI=1S/C65H42N2/c1-2-16-43(17-3-1)44-32-34-47(35-33-44)52-21-8-12-30-61(52)66(48-38-36-46(37-39-48)51-25-14-19-45-18-4-5-20-50(45)51)49-40-41-63-60(42-49)65(57-27-10-6-22-53(57)54-23-7-11-28-58(54)65)59-29-15-26-56-55-24-9-13-31-62(55)67(63)64(56)59/h1-42H
• InChIKey: RYAPZPUZGGBPTG-UHFFFAOYSA-N
• XLogP: 17.08
• TPSA: 8.17 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 6
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	851.07
LogP ≤ 5	17.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine?

The IUPAC name of N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine (CID 135167243) is N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine.

What is the SMILES notation for N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine?

The canonical SMILES for N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine is c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cccc5c6ccccc6n-4c35)cc2)cc1.

What is the InChIKey of N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine?

The InChIKey is RYAPZPUZGGBPTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H42N2/c1-2-16-43(17-3-1)44-32-34-47(35-33-44)52-21-8-12-30-61(52)66(48-38-36-46(37-39-48)51-25-14-19-45-18-4-5-20-50(45)51)49-40-41-63-60(42-49)65(57-27-10-6-22-53(57)54-23-7-11-28-58(54)65)59-29-15-26-56-55-24-9-13-31-62(55)67(63)64(56)59/h1-42H.

What are the key properties of N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine?

N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine has a molecular weight of 851.07 g/mol, XLogP of 17.08, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-naphthalen-1-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14(19),15,17-nonaene-13,9'-fluorene]-16-amine is sourced from PubChem (CID 135167243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).