2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline

C35H25F2N — CID 90266508

IUPAC2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline
SMILESCN(c1ccccc1F)c1c(F)cc(-c2ccccc2)cc1-c1ccc(-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C35H25F2N/c1-38(34-14-8-7-13-32(34)36)35-31(22-30(23-33(35)37)24-9-3-2-4-10-24)27-18-15-26(16-19-27)29-20-17-25-11-5-6-12-28(25)21-29/h2-23H,1H3
InChIKeyWHBFLNNQQWDQHP-UHFFFAOYSA-N
MW497.59 g/mol
LogP9.89
Rot. Bonds5

About 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline

2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline (PubChem CID 90266508) has the molecular formula C35H25F2N and a molecular weight of 497.59 g/mol. Its IUPAC name is 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline.

Molecular Properties

Compound Name2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline
PubChem CID90266508
Molecular FormulaC35H25F2N
Molecular Weight497.59 g/mol
Exact Mass497.20
IUPAC Name2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline
SMILESCN(c1ccccc1F)c1c(F)cc(-c2ccccc2)cc1-c1ccc(-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C35H25F2N/c1-38(34-14-8-7-13-32(34)36)35-31(22-30(23-33(35)37)24-9-3-2-4-10-24)27-18-15-26(16-19-27)29-20-17-25-11-5-6-12-28(25)21-29/h2-23H,1H3
InChIKeyWHBFLNNQQWDQHP-UHFFFAOYSA-N
XLogP9.89
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500497.59
LogP ≤ 59.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(3-naphthalen-2-ylphenyl)-4-phenylaniline
CID 90266570
6-fluoro-N-(2-fluorophenyl)-N-methyl-3-(4-naphthalen-2-ylphenyl)-2-phenylaniline
CID 90266616
2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(3-naphthalen-1-ylphenyl)-4-phenylaniline
CID 90266561
2-fluoro-N-(2-fluorophenyl)-N-methyl-4-naphthalen-2-ylaniline
CID 90266590
2-fluoro-N-(2-fluorophenyl)-N-methyl-4-phenylaniline
CID 90266704
N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-6-phenyl-4-(4-phenylphenyl)aniline
CID 90263984
N-methyl-N-(3-naphthalen-2-ylphenyl)-2-phenylaniline
CID 163929020
1-N,6-N-bis(2-fluoro-4,6-diphenylphenyl)-1-N-(2-fluorophenyl)-6-N-phenylpyrene-1,6-diamine
CID 90264158
2-(3,4,5-triphenylphenyl)naphthalene
CID 54408952
N-tert-butyl-6-fluoro-N-(2-fluorophenyl)-3-(3-naphthalen-2-ylphenyl)-2-phenylaniline
CID 90264016
N-[4-[2-(15,15-dimethyl-10-naphthalen-2-yl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaenyl)ethenyl]phenyl]-2-fluoro-N,4,6-triphenylaniline
CID 123959545
2-[3-(4-methylphenyl)-5-(4-phenylphenyl)phenyl]naphthalene
CID 156673302

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline?
The IUPAC name of 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline (CID 90266508) is 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline.
What is the SMILES notation for 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline?
The canonical SMILES for 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline is CN(c1ccccc1F)c1c(F)cc(-c2ccccc2)cc1-c1ccc(-c2ccc3ccccc3c2)cc1.
What is the InChIKey of 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline?
The InChIKey is WHBFLNNQQWDQHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H25F2N/c1-38(34-14-8-7-13-32(34)36)35-31(22-30(23-33(35)37)24-9-3-2-4-10-24)27-18-15-26(16-19-27)29-20-17-25-11-5-6-12-28(25)21-29/h2-23H,1H3.
What are the key properties of 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline?
2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline has a molecular weight of 497.59 g/mol, XLogP of 9.89, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(2-fluorophenyl)-N-methyl-6-(4-naphthalen-2-ylphenyl)-4-phenylaniline is sourced from PubChem (CID 90266508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).