4-(N-(4-phenylphenyl)anilino)fluoren-9-one

C31H21NO — CID 146540177

IUPAC4-(N-(4-phenylphenyl)anilino)fluoren-9-one
SMILESO=C1c2ccccc2-c2c1cccc2N(c1ccccc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C31H21NO/c33-31-27-15-8-7-14-26(27)30-28(31)16-9-17-29(30)32(24-12-5-2-6-13-24)25-20-18-23(19-21-25)22-10-3-1-4-11-22/h1-21H
InChIKeySXXFESGIBLJCKT-UHFFFAOYSA-N
MW423.52 g/mol
LogP8.03
Rot. Bonds4

About 4-(N-(4-phenylphenyl)anilino)fluoren-9-one

4-(N-(4-phenylphenyl)anilino)fluoren-9-one (PubChem CID 146540177) has the molecular formula C31H21NO and a molecular weight of 423.52 g/mol. Its IUPAC name is 4-(N-(4-phenylphenyl)anilino)fluoren-9-one.

Molecular Properties

Compound Name4-(N-(4-phenylphenyl)anilino)fluoren-9-one
PubChem CID146540177
Molecular FormulaC31H21NO
Molecular Weight423.52 g/mol
Exact Mass423.16
IUPAC Name4-(N-(4-phenylphenyl)anilino)fluoren-9-one
SMILESO=C1c2ccccc2-c2c1cccc2N(c1ccccc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C31H21NO/c33-31-27-15-8-7-14-26(27)30-28(31)16-9-17-29(30)32(24-12-5-2-6-13-24)25-20-18-23(19-21-25)22-10-3-1-4-11-22/h1-21H
InChIKeySXXFESGIBLJCKT-UHFFFAOYSA-N
XLogP8.03
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.52
LogP ≤ 58.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(N-phenylanilino)phenyl]anthracene-9,10-dione
CID 155920076
N,N-bis(4-phenylphenyl)-2-[2-[2-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 163940661
N,2,3-triphenyl-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
CID 174254069
N-phenyl-2-[2-(2-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 172502615
4-(4-phenylphenyl)fluoren-9-one
CID 129258983
N-(4-naphthalen-1-ylphenyl)-N,3-diphenyl-2-(2-phenylphenyl)aniline
CID 168788408
3-naphthalen-1-yl-2-(2-phenylphenyl)-N,N-bis(4-phenylphenyl)aniline
CID 168791024
N-(4-phenylphenyl)-2-[2-(2-phenylphenyl)phenyl]-N-[4-(2-phenylphenyl)phenyl]aniline
CID 172502867
N-(4-naphthalen-2-ylphenyl)-3-phenyl-2-(2-phenylphenyl)-N-(4-phenylphenyl)aniline
CID 168789431
N,3-diphenyl-N,2-bis(2-phenylphenyl)aniline
CID 168788803
N-(3-phenylphenyl)-N-(4-phenylphenyl)-2-[2-(4-phenyl-N-(3-phenylphenyl)anilino)phenyl]aniline
CID 139322197
N-(3-phenylphenyl)-2-[2-(2-phenylphenyl)phenyl]-N-[4-(2-phenylphenyl)phenyl]aniline
CID 172502893

Frequently Asked Questions

What is the IUPAC name of 4-(N-(4-phenylphenyl)anilino)fluoren-9-one?
The IUPAC name of 4-(N-(4-phenylphenyl)anilino)fluoren-9-one (CID 146540177) is 4-(N-(4-phenylphenyl)anilino)fluoren-9-one.
What is the SMILES notation for 4-(N-(4-phenylphenyl)anilino)fluoren-9-one?
The canonical SMILES for 4-(N-(4-phenylphenyl)anilino)fluoren-9-one is O=C1c2ccccc2-c2c1cccc2N(c1ccccc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-(N-(4-phenylphenyl)anilino)fluoren-9-one?
The InChIKey is SXXFESGIBLJCKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21NO/c33-31-27-15-8-7-14-26(27)30-28(31)16-9-17-29(30)32(24-12-5-2-6-13-24)25-20-18-23(19-21-25)22-10-3-1-4-11-22/h1-21H.
What are the key properties of 4-(N-(4-phenylphenyl)anilino)fluoren-9-one?
4-(N-(4-phenylphenyl)anilino)fluoren-9-one has a molecular weight of 423.52 g/mol, XLogP of 8.03, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(N-(4-phenylphenyl)anilino)fluoren-9-one is sourced from PubChem (CID 146540177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).