4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline

C32H25N — CID 157107572

IUPAC4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline
SMILESCc1ccc2c(c1)-c1cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc1C2
InChIInChI=1S/C32H25N/c1-23-12-13-26-21-27-15-14-25(22-32(27)31(26)20-23)24-16-18-30(19-17-24)33(28-8-4-2-5-9-28)29-10-6-3-7-11-29/h2-20,22H,21H2,1H3
InChIKeyDXWVCOPODQUJRF-UHFFFAOYSA-N
MW423.56 g/mol
LogP8.70
Rot. Bonds4

About 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline

4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline (PubChem CID 157107572) has the molecular formula C32H25N and a molecular weight of 423.56 g/mol. Its IUPAC name is 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline.

Molecular Properties

Compound Name4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline
PubChem CID157107572
Molecular FormulaC32H25N
Molecular Weight423.56 g/mol
Exact Mass423.20
IUPAC Name4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline
SMILESCc1ccc2c(c1)-c1cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc1C2
InChIInChI=1S/C32H25N/c1-23-12-13-26-21-27-15-14-25(22-32(27)31(26)20-23)24-16-18-30(19-17-24)33(28-8-4-2-5-9-28)29-10-6-3-7-11-29/h2-20,22H,21H2,1H3
InChIKeyDXWVCOPODQUJRF-UHFFFAOYSA-N
XLogP8.70
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.56
LogP ≤ 58.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline 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

N,N-diphenyl-4-(6-phenyl-9H-fluoren-3-yl)aniline
CID 158121495
4-(9H-fluoren-3-yl)-N,N-diphenylaniline
CID 157436916
N,4-diphenyl-N-[4-[6-[4-(N-(4-phenylphenyl)anilino)phenyl]-9H-fluoren-3-yl]phenyl]aniline;2-methyl-N-[4-[6-[4-(2-methyl-N-(2-methylphenyl)anilino)phenyl]-9H-fluoren-3-yl]phenyl]-N-(2-methylphenyl)aniline;2-methyl-N-[4-[6-[4-(N-(2-methylphenyl)anilino)phenyl]-9H-fluoren-3-yl]phenyl]-N-phenylaniline;bis(4-methyl-N-[4-[6-[4-(N-(4-methylphenyl)anilino)phenyl]-9H-fluoren-3-yl]phenyl]-N-phenylaniline)
CID 157494177
N,N-diphenyl-3-[6-[3-(N-phenylanilino)phenyl]-9H-fluoren-3-yl]aniline
CID 157405754
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
4-N-[4-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
CID 165386569
1-N-[4-[4-(N-[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]anilino)phenyl]phenyl]-4-N,4-N-bis(4-methylphenyl)-1-N-phenylbenzene-1,4-diamine
CID 21351107
4-N,4-N-bis(4-methylphenyl)-1-N-phenyl-1-N-[4-[4-(N-phenylanilino)phenyl]phenyl]benzene-1,4-diamine
CID 171844865
4-methyl-N-[4-[4-(N-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]anilino)phenyl]phenyl]-N-phenylaniline
CID 22598588
N,N-bis(4-methylphenyl)-6,12-dihydroindeno[1,2-b]fluoren-2-amine
CID 71099967
1-N-[3-(9H-fluoren-3-yl)phenyl]-1-N-methyl-4-N,4-N-diphenylbenzene-1,4-diamine
CID 121465238
N-[4-[3,5-bis[4-(4-methyl-N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline;4-[3,5-bis[4-(N-phenylanilino)phenyl]phenyl]-N,N-diphenylaniline
CID 159992995

Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline?
The IUPAC name of 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline (CID 157107572) is 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline.
What is the SMILES notation for 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline?
The canonical SMILES for 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline is Cc1ccc2c(c1)-c1cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc1C2.
What is the InChIKey of 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline?
The InChIKey is DXWVCOPODQUJRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H25N/c1-23-12-13-26-21-27-15-14-25(22-32(27)31(26)20-23)24-16-18-30(19-17-24)33(28-8-4-2-5-9-28)29-10-6-3-7-11-29/h2-20,22H,21H2,1H3.
What are the key properties of 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline?
4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline has a molecular weight of 423.56 g/mol, XLogP of 8.70, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-9H-fluoren-3-yl)-N,N-diphenylaniline is sourced from PubChem (CID 157107572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).