N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine

C67H46N2 — CID 118505705

IUPACN,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccc(N(c7ccccc7)c7ccc8c(c7)-c7ccccc7C8(c7ccccc7)c7ccccc7)cc6)c5)cc43)c2)cc1
InChIInChI=1S/C67H46N2/c1-5-19-47(20-6-1)51-23-18-30-57(44-51)69-65-34-16-14-32-60(65)61-41-37-52(45-66(61)69)50-22-17-21-49(43-50)48-35-38-56(39-36-48)68(55-28-11-4-12-29-55)58-40-42-64-62(46-58)59-31-13-15-33-63(59)67(64,53-24-7-2-8-25-53)54-26-9-3-10-27-54/h1-46H
InChIKeyQJNQCWHKKGGOSQ-UHFFFAOYSA-N
MW879.12 g/mol
LogP17.62
Rot. Bonds9

About N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine

N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine (PubChem CID 118505705) has the molecular formula C67H46N2 and a molecular weight of 879.12 g/mol. Its IUPAC name is N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine.

Molecular Properties

Compound NameN,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
PubChem CID118505705
Molecular FormulaC67H46N2
Molecular Weight879.12 g/mol
Exact Mass878.37
IUPAC NameN,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccc(N(c7ccccc7)c7ccc8c(c7)-c7ccccc7C8(c7ccccc7)c7ccccc7)cc6)c5)cc43)c2)cc1
InChIInChI=1S/C67H46N2/c1-5-19-47(20-6-1)51-23-18-30-57(44-51)69-65-34-16-14-32-60(65)61-41-37-52(45-66(61)69)50-22-17-21-49(43-50)48-35-38-56(39-36-48)68(55-28-11-4-12-29-55)58-40-42-64-62(46-58)59-31-13-15-33-63(59)67(64,53-24-7-2-8-25-53)54-26-9-3-10-27-54/h1-46H
InChIKeyQJNQCWHKKGGOSQ-UHFFFAOYSA-N
XLogP17.62
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms69
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500879.12
LogP ≤ 517.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
CID 118505787
9,9-diphenyl-N-[3-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 118505688
N-(3-carbazol-9-ylphenyl)-N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-9,9-diphenylfluoren-3-amine
CID 121423893
4-[3-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N,N-diphenylaniline
CID 118505684
N-[3-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-3-amine;N-[3-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-phenyl-N-[3-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine;N-phenyl-N-[3-[3-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 160980279
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(4-dibenzofuran-3-ylphenyl)-9,9-diphenylfluoren-3-amine
CID 121425002
9,9-diphenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 90124595
N-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N,4-diphenylaniline
CID 118682510
2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 118265716
N-[4-[2-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline
CID 118337165
9,9-diphenyl-N-(3-phenylphenyl)-N-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]fluoren-3-amine
CID 122524701
N,9,9-triphenyl-N-[3-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]fluoren-2-amine
CID 118505876

Frequently Asked Questions

What is the IUPAC name of N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine?
The IUPAC name of N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine (CID 118505705) is N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine.
What is the SMILES notation for N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine?
The canonical SMILES for N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine is c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccc(N(c7ccccc7)c7ccc8c(c7)-c7ccccc7C8(c7ccccc7)c7ccccc7)cc6)c5)cc43)c2)cc1.
What is the InChIKey of N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine?
The InChIKey is QJNQCWHKKGGOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H46N2/c1-5-19-47(20-6-1)51-23-18-30-57(44-51)69-65-34-16-14-32-60(65)61-41-37-52(45-66(61)69)50-22-17-21-49(43-50)48-35-38-56(39-36-48)68(55-28-11-4-12-29-55)58-40-42-64-62(46-58)59-31-13-15-33-63(59)67(64,53-24-7-2-8-25-53)54-26-9-3-10-27-54/h1-46H.
What are the key properties of N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine?
N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine has a molecular weight of 879.12 g/mol, XLogP of 17.62, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine is sourced from PubChem (CID 118505705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).