3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline

C43H31N — CID 146386867

IUPAC3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)Cc4ccccc4-5)c3)cc2)cc1
InChIInChI=1S/C43H31N/c1-3-10-31(11-4-1)33-18-23-39(24-19-33)44(40-25-20-34(21-26-40)32-12-5-2-6-13-32)41-16-9-15-35(30-41)36-22-27-43-38(28-36)29-37-14-7-8-17-42(37)43/h1-28,30H,29H2
InChIKeyWNEPPUYLQHWEGI-UHFFFAOYSA-N
MW561.73 g/mol
LogP11.73
Rot. Bonds6

About 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline

3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline (PubChem CID 146386867) has the molecular formula C43H31N and a molecular weight of 561.73 g/mol. Its IUPAC name is 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline.

Molecular Properties

Compound Name3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline
PubChem CID146386867
Molecular FormulaC43H31N
Molecular Weight561.73 g/mol
Exact Mass561.25
IUPAC Name3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)Cc4ccccc4-5)c3)cc2)cc1
InChIInChI=1S/C43H31N/c1-3-10-31(11-4-1)33-18-23-39(24-19-33)44(40-25-20-34(21-26-40)32-12-5-2-6-13-32)41-16-9-15-35(30-41)36-22-27-43-38(28-36)29-37-14-7-8-17-42(37)43/h1-28,30H,29H2
InChIKeyWNEPPUYLQHWEGI-UHFFFAOYSA-N
XLogP11.73
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.73
LogP ≤ 511.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(9H-fluoren-3-yl)-N,N-diphenylaniline
CID 157436916
N,N-diphenyl-3-[6-[3-(N-phenylanilino)phenyl]-9H-fluoren-3-yl]aniline
CID 157405754
N,N-diphenyl-9H-fluoren-2-amine
CID 20734444
N,N-diphenyl-4-(6-phenyl-9H-fluoren-3-yl)aniline;N,N-diphenyl-4-[6-(2-phenylphenyl)-9H-fluoren-3-yl]aniline;N,N-diphenyl-4-[6-(3-phenylphenyl)-9H-fluoren-3-yl]aniline;4-(9H-fluoren-3-yl)-N,N-diphenylaniline
CID 161002585
N,N-diphenyl-4-(6-phenyl-9H-fluoren-3-yl)aniline
CID 158121495
1-N-[3-(9H-fluoren-3-yl)phenyl]-1-N-methyl-4-N,4-N-diphenylbenzene-1,4-diamine
CID 121465238
3-phenyl-N-(4-phenylphenyl)-N-[4-[2-[4-(4-phenyl-N-(3-phenylphenyl)anilino)phenyl]phenyl]phenyl]aniline
CID 121386998
N,N-diphenyl-3-[4-[3-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline;N,N-diphenyl-3-[4-[3-(N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]anilino)phenyl]phenyl]aniline;N-phenyl-3-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-[3-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline;N-phenyl-3-[4-[4-(N-phenylanilino)phenyl]phenyl]-N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline
CID 159305688
N,3-diphenyl-N-[4-[4-(N-[4-[4-(N-[4-[4-(N-(3-phenylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline
CID 22013506
N,3-diphenyl-N-[4-[4-(3-phenyl-N-(3-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 59090384
4-(9H-fluoren-1-yl)-3-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 134320795
N-(9H-fluoren-2-yl)-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]-9H-fluoren-2-amine;N-[4-[4-[4-(4-methylphenyl)-N-[4-(4-methylphenyl)phenyl]anilino]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)-9H-fluorene-2,7-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]benzene-1,4-diamine
CID 158984824

Frequently Asked Questions

What is the IUPAC name of 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline?
The IUPAC name of 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline (CID 146386867) is 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline.
What is the SMILES notation for 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline?
The canonical SMILES for 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)Cc4ccccc4-5)c3)cc2)cc1.
What is the InChIKey of 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline?
The InChIKey is WNEPPUYLQHWEGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H31N/c1-3-10-31(11-4-1)33-18-23-39(24-19-33)44(40-25-20-34(21-26-40)32-12-5-2-6-13-32)41-16-9-15-35(30-41)36-22-27-43-38(28-36)29-37-14-7-8-17-42(37)43/h1-28,30H,29H2.
What are the key properties of 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline?
3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline has a molecular weight of 561.73 g/mol, XLogP of 11.73, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9H-fluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline is sourced from PubChem (CID 146386867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).