N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine

C73H48N2 — CID 164724972

IUPACN-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine
SMILESc1ccc(-c2ccc3c4ccc(-c5ccccc5)cc4n(-c4ccccc4-c4ccc(-c5ccc(N(c6ccccc6)c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)cc5)cc4)c3c2)cc1
InChIInChI=1S/C73H48N2/c1-4-18-49(19-5-1)54-38-43-64-65-44-39-55(50-20-6-2-7-21-50)47-72(65)75(71(64)46-54)70-31-17-13-24-59(70)53-34-32-51(33-35-53)52-36-40-57(41-37-52)74(56-22-8-3-9-23-56)58-42-45-63-62-27-12-16-30-68(62)73(69(63)48-58)66-28-14-10-25-60(66)61-26-11-15-29-67(61)73/h1-48H
InChIKeyPWGZOMPYUWKAPE-UHFFFAOYSA-N
MW953.20 g/mol
LogP19.26
Rot. Bonds8

About N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine

N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine (PubChem CID 164724972) has the molecular formula C73H48N2 and a molecular weight of 953.20 g/mol. Its IUPAC name is N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine.

Molecular Properties

Compound NameN-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine
PubChem CID164724972
Molecular FormulaC73H48N2
Molecular Weight953.20 g/mol
Exact Mass952.38
IUPAC NameN-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine
SMILESc1ccc(-c2ccc3c4ccc(-c5ccccc5)cc4n(-c4ccccc4-c4ccc(-c5ccc(N(c6ccccc6)c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)cc5)cc4)c3c2)cc1
InChIInChI=1S/C73H48N2/c1-4-18-49(19-5-1)54-38-43-64-65-44-39-55(50-20-6-2-7-21-50)47-72(65)75(71(64)46-54)70-31-17-13-24-59(70)53-34-32-51(33-35-53)52-36-40-57(41-37-52)74(56-22-8-3-9-23-56)58-42-45-63-62-27-12-16-30-68(62)73(69(63)48-58)66-28-14-10-25-60(66)61-26-11-15-29-67(61)73/h1-48H
InChIKeyPWGZOMPYUWKAPE-UHFFFAOYSA-N
XLogP19.26
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms75
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500953.20
LogP ≤ 519.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-4-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 155037754
N-[4-[3-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
CID 167322443
N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,4-diphenylaniline;N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[4-[4-(2-carbazol-9-ylphenyl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine
CID 165066958
4-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(4-naphthalen-1-ylphenyl)-N-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]aniline
CID 167322620
3-phenyl-N-[4-[4-[2-(2-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 155037985
2-N'-[4-[4-[3-[4-(N-[4-(4-carbazol-9-ylphenyl)phenyl]-4-phenylanilino)phenyl]phenyl]phenyl]phenyl]-7-N'-phenyl-2-N'-(4-phenylphenyl)-7-N'-[4-(4-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2',7'-diamine
CID 167023334
N-[2-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 118265779
N-[4-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-triphenylen-2-yl-9,9'-spirobi[fluorene]-2-amine
CID 130308738
4-phenyl-N-[4-[4-[2-(2-phenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 155037999
9,9-diphenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 90124595
N,9,9-triphenyl-N-[3-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]fluoren-2-amine
CID 118505876
N-[3-[3-(9-naphthalen-1-ylcarbazol-2-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-[3-[3-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine;N-(4-phenylphenyl)-N-[3-[3-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 160921499

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine?
The IUPAC name of N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine (CID 164724972) is N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine.
What is the SMILES notation for N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine?
The canonical SMILES for N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine is c1ccc(-c2ccc3c4ccc(-c5ccccc5)cc4n(-c4ccccc4-c4ccc(-c5ccc(N(c6ccccc6)c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)cc5)cc4)c3c2)cc1.
What is the InChIKey of N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine?
The InChIKey is PWGZOMPYUWKAPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H48N2/c1-4-18-49(19-5-1)54-38-43-64-65-44-39-55(50-20-6-2-7-21-50)47-72(65)75(71(64)46-54)70-31-17-13-24-59(70)53-34-32-51(33-35-53)52-36-40-57(41-37-52)74(56-22-8-3-9-23-56)58-42-45-63-62-27-12-16-30-68(62)73(69(63)48-58)66-28-14-10-25-60(66)61-26-11-15-29-67(61)73/h1-48H.
What are the key properties of N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine?
N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine has a molecular weight of 953.20 g/mol, XLogP of 19.26, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[2-(2,7-diphenylcarbazol-9-yl)phenyl]phenyl]phenyl]-N-phenyl-9,9'-spirobi[fluorene]-2-amine is sourced from PubChem (CID 164724972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).