N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine

C55H38N2 — CID 143437968

IUPACN-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine
SMILESC1=CC2=C(CC1)C1(c3ccccc32)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccccc3-c3ccccc3)cc21
InChIInChI=1S/C55H38N2/c1-2-16-37(17-3-1)41-18-7-13-27-52(41)56(38-30-32-39(33-31-38)57-53-28-14-8-22-46(53)47-23-9-15-29-54(47)57)40-34-35-45-44-21-6-12-26-50(44)55(51(45)36-40)48-24-10-4-19-42(48)43-20-5-11-25-49(43)55/h1-10,12-24,26-36H,11,25H2
InChIKeyCQGVJJYITPLRCT-UHFFFAOYSA-N
MW726.92 g/mol
LogP14.35
Rot. Bonds5

About N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine

N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine (PubChem CID 143437968) has the molecular formula C55H38N2 and a molecular weight of 726.92 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine
PubChem CID143437968
Molecular FormulaC55H38N2
Molecular Weight726.92 g/mol
Exact Mass726.30
IUPAC NameN-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine
SMILESC1=CC2=C(CC1)C1(c3ccccc32)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccccc3-c3ccccc3)cc21
InChIInChI=1S/C55H38N2/c1-2-16-37(17-3-1)41-18-7-13-27-52(41)56(38-30-32-39(33-31-38)57-53-28-14-8-22-46(53)47-23-9-15-29-54(47)57)40-34-35-45-44-21-6-12-26-50(44)55(51(45)36-40)48-24-10-4-19-42(48)43-20-5-11-25-49(43)55/h1-10,12-24,26-36H,11,25H2
InChIKeyCQGVJJYITPLRCT-UHFFFAOYSA-N
XLogP14.35
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500726.92
LogP ≤ 514.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-phenyl-N-(2-phenylphenyl)-N-spiro[1,2-dihydrofluorene-9,9'-fluorene]-3'-ylcarbazol-3-amine
CID 166705704
N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;ethane
CID 145464353
N-[2-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 118265779
N,9,9-triphenyl-N-[2-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine
CID 118640942
N-(4-carbazol-9-ylphenyl)-N-[3-phenyl-2-(2-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 168790311
N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[2-(3-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 155138419
N-(4-carbazol-9-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-2'-amine
CID 135166476
N,10'-diphenyl-N-(9-phenylcarbazol-3-yl)spiro[1,2-dihydrofluorene-9,9'-acridine]-2'-amine
CID 166844754
N-[4-[4-(3,4-dihydrocarbazol-9-yl)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 129311526
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(9-phenylfluoren-9-yl)phenyl]-2-(4-phenylphenyl)aniline
CID 121381212
N-(4-carbazol-9-ylphenyl)-N-phenyl-4-(3-phenyl-5-spiro[1,2-dihydrofluorene-9,9'-fluorene]-3'-ylquinoxalin-2-yl)aniline
CID 89079727
N-[2-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 118087630

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine (CID 143437968) is N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine is C1=CC2=C(CC1)C1(c3ccccc32)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccccc3-c3ccccc3)cc21.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine?
The InChIKey is CQGVJJYITPLRCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H38N2/c1-2-16-37(17-3-1)41-18-7-13-27-52(41)56(38-30-32-39(33-31-38)57-53-28-14-8-22-46(53)47-23-9-15-29-54(47)57)40-34-35-45-44-21-6-12-26-50(44)55(51(45)36-40)48-24-10-4-19-42(48)43-20-5-11-25-49(43)55/h1-10,12-24,26-36H,11,25H2.
What are the key properties of N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine?
N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine has a molecular weight of 726.92 g/mol, XLogP of 14.35, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-N-(2-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine is sourced from PubChem (CID 143437968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).