N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine

C68H48N2 — CID 129061482

IUPACN,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine
SMILESc1ccc(C2c3ccccc3-c3ccc(N(c4ccccc4)c4cccc(-c5ccccc5-c5cccc(N(c6ccccc6)c6ccc7c(c6)C(c6ccccc6)c6ccccc6-7)c5)c4)cc32)cc1
InChIInChI=1S/C68H48N2/c1-5-21-47(22-6-1)67-63-37-17-15-35-59(63)61-41-39-55(45-65(61)67)69(51-27-9-3-10-28-51)53-31-19-25-49(43-53)57-33-13-14-34-58(57)50-26-20-32-54(44-50)70(52-29-11-4-12-30-52)56-40-42-62-60-36-16-18-38-64(60)68(66(62)46-56)48-23-7-2-8-24-48/h1-46,67-68H
InChIKeyHUOBPEBKMFNOBM-UHFFFAOYSA-N
MW893.15 g/mol
LogP18.28
Rot. Bonds10

About N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine

N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine (PubChem CID 129061482) has the molecular formula C68H48N2 and a molecular weight of 893.15 g/mol. Its IUPAC name is N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine.

Molecular Properties

Compound NameN,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine
PubChem CID129061482
Molecular FormulaC68H48N2
Molecular Weight893.15 g/mol
Exact Mass892.38
IUPAC NameN,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine
SMILESc1ccc(C2c3ccccc3-c3ccc(N(c4ccccc4)c4cccc(-c5ccccc5-c5cccc(N(c6ccccc6)c6ccc7c(c6)C(c6ccccc6)c6ccccc6-7)c5)c4)cc32)cc1
InChIInChI=1S/C68H48N2/c1-5-21-47(22-6-1)67-63-37-17-15-35-59(63)61-41-39-55(45-65(61)67)69(51-27-9-3-10-28-51)53-31-19-25-49(43-53)57-33-13-14-34-58(57)50-26-20-32-54(44-50)70(52-29-11-4-12-30-52)56-40-42-62-60-36-16-18-38-64(60)68(66(62)46-56)48-23-7-2-8-24-48/h1-46,67-68H
InChIKeyHUOBPEBKMFNOBM-UHFFFAOYSA-N
XLogP18.28
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500893.15
LogP ≤ 518.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-9H-fluoren-2-amine
CID 129265016
9,9-dimethyl-N-phenyl-N-[3-(9-phenyl-9H-fluoren-2-yl)phenyl]fluoren-2-amine
CID 144639598
N,N-diphenyl-3-[2-[3-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline
CID 58729717
N,N-bis(4-carbazol-9-ylphenyl)-9-phenyl-9H-fluoren-2-amine
CID 167110197
3-(2-phenylphenyl)-N,N-bis[4-[4-(4-phenylphenyl)phenyl]phenyl]aniline
CID 146665629
3-phenyl-N-[4-[2-(9-phenyl-9,10-dihydrophenanthren-2-yl)phenyl]phenyl]-N-(3-phenylphenyl)aniline
CID 144907604
9-[3,5-bis[3,6-bis(N-phenylanilino)-9H-fluoren-9-yl]phenyl]-3-N,3-N,6-N,6-N-tetraphenyl-9H-fluorene-3,6-diamine
CID 101256601
6-N,12-N-bis[3-(9H-fluoren-9-yl)phenyl]-6-N,12-N-bis[4-(4-phenylphenyl)phenyl]chrysene-6,12-diamine
CID 58421134
N-phenyl-N-(9-phenyl-9H-fluoren-2-yl)spiro[benzo[a]phenalene-7,9'-thioxanthene]-3'-amine
CID 164793910
3-phenyl-N-[4-(2-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-[2-(3-phenylphenyl)phenyl]phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-[2-(4-phenylphenyl)phenyl]phenyl]aniline
CID 161496261
4-phenyl-N-(4-phenylphenyl)-N-[4-[9-phenyl-1-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]-9H-fluoren-3-yl]phenyl]aniline
CID 145060230
3-phenyl-N-(4-phenylphenyl)-N-[4-[2-[4-(4-phenyl-N-(3-phenylphenyl)anilino)phenyl]phenyl]phenyl]aniline
CID 121386998

Frequently Asked Questions

What is the IUPAC name of N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine?
The IUPAC name of N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine (CID 129061482) is N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine.
What is the SMILES notation for N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine?
The canonical SMILES for N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine is c1ccc(C2c3ccccc3-c3ccc(N(c4ccccc4)c4cccc(-c5ccccc5-c5cccc(N(c6ccccc6)c6ccc7c(c6)C(c6ccccc6)c6ccccc6-7)c5)c4)cc32)cc1.
What is the InChIKey of N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine?
The InChIKey is HUOBPEBKMFNOBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H48N2/c1-5-21-47(22-6-1)67-63-37-17-15-35-59(63)61-41-39-55(45-65(61)67)69(51-27-9-3-10-28-51)53-31-19-25-49(43-53)57-33-13-14-34-58(57)50-26-20-32-54(44-50)70(52-29-11-4-12-30-52)56-40-42-62-60-36-16-18-38-64(60)68(66(62)46-56)48-23-7-2-8-24-48/h1-46,67-68H.
What are the key properties of N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine?
N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine has a molecular weight of 893.15 g/mol, XLogP of 18.28, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,9-diphenyl-N-[3-[2-[3-(N-(9-phenyl-9H-fluoren-2-yl)anilino)phenyl]phenyl]phenyl]-9H-fluoren-2-amine is sourced from PubChem (CID 129061482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).