N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine

C59H40N2 — CID 135166874

IUPACN-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine
SMILESc1ccc(N2c3ccccc3C3(c4ccccc4-c4c(N(c5ccccc5)c5ccccc5-c5ccccc5-c5cccc6ccccc56)cccc43)c3ccccc32)cc1
InChIInChI=1S/C59H40N2/c1-3-23-42(24-4-1)60(54-37-16-12-30-48(54)47-29-10-9-28-46(47)45-32-19-22-41-21-7-8-27-44(41)45)57-40-20-36-53-58(57)49-31-11-13-33-50(49)59(53)51-34-14-17-38-55(51)61(43-25-5-2-6-26-43)56-39-18-15-35-52(56)59/h1-40H
InChIKeyQCBMLDFPRIBTHA-UHFFFAOYSA-N
MW776.98 g/mol
LogP15.79
Rot. Bonds6

About N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine

N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine (PubChem CID 135166874) has the molecular formula C59H40N2 and a molecular weight of 776.98 g/mol. Its IUPAC name is N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine.

Molecular Properties

Compound NameN-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine
PubChem CID135166874
Molecular FormulaC59H40N2
Molecular Weight776.98 g/mol
Exact Mass776.32
IUPAC NameN-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine
SMILESc1ccc(N2c3ccccc3C3(c4ccccc4-c4c(N(c5ccccc5)c5ccccc5-c5ccccc5-c5cccc6ccccc56)cccc43)c3ccccc32)cc1
InChIInChI=1S/C59H40N2/c1-3-23-42(24-4-1)60(54-37-16-12-30-48(54)47-29-10-9-28-46(47)45-32-19-22-41-21-7-8-27-44(41)45)57-40-20-36-53-58(57)49-31-11-13-33-50(49)59(53)51-34-14-17-38-55(51)61(43-25-5-2-6-26-43)56-39-18-15-35-52(56)59/h1-40H
InChIKeyQCBMLDFPRIBTHA-UHFFFAOYSA-N
XLogP15.79
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500776.98
LogP ≤ 515.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 135166872
N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenyl-N-triphenylen-2-ylspiro[acridine-9,9'-fluorene]-4'-amine
CID 135166879
N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-naphthalen-1-ylphenyl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine;N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenyl-N-[2-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine
CID 157379231
N,N,10-triphenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 134309245
N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenyl-N-[4-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 157340492
N,10-diphenyl-N-[2-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-4'-amine
CID 135166793
N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 135166724
N-(4-naphthalen-1-ylphenyl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine
CID 135166717
10-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-4'-amine
CID 135166841
N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine
CID 135166722
N,10-diphenyl-N-(9,9'-spirobi[fluorene]-4-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 135168805
N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenyl-N-[4-(4-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine;N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)spiro[acridine-9,9'-fluorene]-2'-amine
CID 160984403

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine?
The IUPAC name of N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine (CID 135166874) is N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine.
What is the SMILES notation for N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine?
The canonical SMILES for N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine is c1ccc(N2c3ccccc3C3(c4ccccc4-c4c(N(c5ccccc5)c5ccccc5-c5ccccc5-c5cccc6ccccc56)cccc43)c3ccccc32)cc1.
What is the InChIKey of N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine?
The InChIKey is QCBMLDFPRIBTHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H40N2/c1-3-23-42(24-4-1)60(54-37-16-12-30-48(54)47-29-10-9-28-46(47)45-32-19-22-41-21-7-8-27-44(41)45)57-40-20-36-53-58(57)49-31-11-13-33-50(49)59(53)51-34-14-17-38-55(51)61(43-25-5-2-6-26-43)56-39-18-15-35-52(56)59/h1-40H.
What are the key properties of N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine?
N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine has a molecular weight of 776.98 g/mol, XLogP of 15.79, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine is sourced from PubChem (CID 135166874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).