N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine

C51H36N2 — CID 162779800

IUPACN,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine
SMILESc1ccc(N(c2ccc(-c3ccc4c(c3)C3(Cc5ccccc5C3)c3ccccc3-4)cc2)c2ccc3c4ccccc4n(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C51H36N2/c1-3-15-39(16-4-1)52(42-28-30-46-45-20-10-12-22-49(45)53(50(46)32-42)40-17-5-2-6-18-40)41-26-23-35(24-27-41)36-25-29-44-43-19-9-11-21-47(43)51(48(44)31-36)33-37-13-7-8-14-38(37)34-51/h1-32H,33-34H2
InChIKeyWDXDJBORCUQXFZ-UHFFFAOYSA-N
MW676.86 g/mol
LogP12.99
Rot. Bonds5

About N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine

N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine (PubChem CID 162779800) has the molecular formula C51H36N2 and a molecular weight of 676.86 g/mol. Its IUPAC name is N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine.

Molecular Properties

Compound NameN,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine
PubChem CID162779800
Molecular FormulaC51H36N2
Molecular Weight676.86 g/mol
Exact Mass676.29
IUPAC NameN,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine
SMILESc1ccc(N(c2ccc(-c3ccc4c(c3)C3(Cc5ccccc5C3)c3ccccc3-4)cc2)c2ccc3c4ccccc4n(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C51H36N2/c1-3-15-39(16-4-1)52(42-28-30-46-45-20-10-12-22-49(45)53(50(46)32-42)40-17-5-2-6-18-40)41-26-23-35(24-27-41)36-25-29-44-43-19-9-11-21-47(43)51(48(44)31-36)33-37-13-7-8-14-38(37)34-51/h1-32H,33-34H2
InChIKeyWDXDJBORCUQXFZ-UHFFFAOYSA-N
XLogP12.99
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500676.86
LogP ≤ 512.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-phenylphenyl)spiro[1,3-dihydroindene-2,9'-fluorene]-2'-amine
CID 162779846
9-(4-fluorophenyl)-N-(4-phenylphenyl)-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-3-amine
CID 162779812
N-dibenzofuran-3-yl-9-phenyl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
CID 162779852
N-dibenzofuran-2-yl-9-phenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-3'-ylphenyl)carbazol-2-amine
CID 162779801
9-phenyl-3-[4-[7'-[4-(9-phenylcarbazol-3-yl)phenyl]spiro[1,3-dihydroindene-2,9'-fluorene]-2'-yl]phenyl]carbazole
CID 58987327
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine;N-(9,9-dimethylfluoren-3-yl)-9-phenyl-N-(3-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine;N-(2-naphthalen-2-ylphenyl)-9-phenyl-N-(2-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine;N-naphthalen-2-yl-9-phenyl-N-(3-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine
CID 163655086
N-[4-[4-[(9,9-dimethylfluoren-3-yl)-(9-phenylcarbazol-2-yl)amino]phenyl]phenyl]-N,9-diphenylcarbazol-2-amine
CID 134164505
9-(4-fluorophenyl)-N-naphthalen-2-yl-N-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylcarbazol-2-amine
CID 162779844
N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine
CID 164973496
9,9-dimethyl-N-phenyl-7-(9-phenylcarbazol-3-yl)-N-[4-(9-phenylcarbazol-2-yl)phenyl]fluoren-2-amine
CID 71038312
N,9-diphenyl-N-(9-phenylspiro[benzo[a]phenalene-7,9'-fluorene]-3-yl)carbazol-2-amine
CID 164732106
N-(9,9-dimethylfluoren-4-yl)-N-[3-(9-phenylcarbazol-3-yl)phenyl]spiro[1,3-dihydroindene-2,9'-fluorene]-2'-amine
CID 162779880

Frequently Asked Questions

What is the IUPAC name of N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine?
The IUPAC name of N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine (CID 162779800) is N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine.
What is the SMILES notation for N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine?
The canonical SMILES for N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine is c1ccc(N(c2ccc(-c3ccc4c(c3)C3(Cc5ccccc5C3)c3ccccc3-4)cc2)c2ccc3c4ccccc4n(-c4ccccc4)c3c2)cc1.
What is the InChIKey of N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine?
The InChIKey is WDXDJBORCUQXFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H36N2/c1-3-15-39(16-4-1)52(42-28-30-46-45-20-10-12-22-49(45)53(50(46)32-42)40-17-5-2-6-18-40)41-26-23-35(24-27-41)36-25-29-44-43-19-9-11-21-47(43)51(48(44)31-36)33-37-13-7-8-14-38(37)34-51/h1-32H,33-34H2.
What are the key properties of N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine?
N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine has a molecular weight of 676.86 g/mol, XLogP of 12.99, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,9-diphenyl-N-(4-spiro[1,3-dihydroindene-2,9'-fluorene]-2'-ylphenyl)carbazol-2-amine is sourced from PubChem (CID 162779800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).