4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline

C26H19F2N — CID 142698586

IUPAC4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline
SMILESC=Cc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(F)c1F
InChIInChI=1S/C26H19F2N/c1-2-19-15-18-24(26(28)25(19)27)20-13-16-23(17-14-20)29(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h2-18H,1H2
InChIKeyFWVBXFRDNHVUDE-UHFFFAOYSA-N
MW383.44 g/mol
LogP7.74
Rot. Bonds5

About 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline

4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline (PubChem CID 142698586) has the molecular formula C26H19F2N and a molecular weight of 383.44 g/mol. Its IUPAC name is 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline.

Molecular Properties

Compound Name4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline
PubChem CID142698586
Molecular FormulaC26H19F2N
Molecular Weight383.44 g/mol
Exact Mass383.15
IUPAC Name4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline
SMILESC=Cc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(F)c1F
InChIInChI=1S/C26H19F2N/c1-2-19-15-18-24(26(28)25(19)27)20-13-16-23(17-14-20)29(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h2-18H,1H2
InChIKeyFWVBXFRDNHVUDE-UHFFFAOYSA-N
XLogP7.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.44
LogP ≤ 57.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethenyl-N,N-diphenylaniline;4-ethenyl-N-phenyl-N-(4-phenylphenyl)aniline
CID 162186031
4-(2,3,4,5,6-pentafluorophenyl)-N,N-diphenylaniline
CID 102107695
N,N-diphenyl-4-[4-[4-[4-(N-phenylanilino)phenyl]-N-[4-[4-[4-[4-(N-phenylanilino)phenyl]-N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino]phenyl]phenyl]anilino]phenyl]aniline
CID 19708505
1-N,1-N,4-N-triphenyl-4-N-[4-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine;1-N,1-N,4-N-triphenyl-4-N-[4-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]benzene-1,4-diamine
CID 162077719
N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;N,N-diphenyl-4-[4-(N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]aniline;N,N-diphenyl-4-[4-[4-(N-[4-[4-(N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline
CID 158321968
4-N-[4-[4-(2,2-diphenylethenyl)naphthalen-1-yl]phenyl]-1-N,1-N-diphenyl-4-N-[4-(N-phenylanilino)phenyl]benzene-1,4-diamine
CID 22983512
4-[4,5-diphenyl-2-[4-(N-phenylanilino)phenyl]phenyl]-N,N-diphenylaniline
CID 58943769
N-[4-[2-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 121386996
N,N,3-triphenyl-4-[4-(N-phenylanilino)phenyl]aniline
CID 18780381
4-[2-[4-(4-ethenylphenyl)phenyl]ethenyl]-N,N-diphenylaniline
CID 142226896
3-(2-ethenylphenyl)-N,N-diphenylaniline
CID 91124451
N-phenyl-4-(4-phenylphenyl)-N-[4-[4-(N-[4-[4-[4-(N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]anilino)phenyl]phenyl]phenyl]anilino)phenyl]phenyl]aniline
CID 59510908

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline?
The IUPAC name of 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline (CID 142698586) is 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline.
What is the SMILES notation for 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline?
The canonical SMILES for 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline is C=Cc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(F)c1F.
What is the InChIKey of 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline?
The InChIKey is FWVBXFRDNHVUDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19F2N/c1-2-19-15-18-24(26(28)25(19)27)20-13-16-23(17-14-20)29(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h2-18H,1H2.
What are the key properties of 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline?
4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline has a molecular weight of 383.44 g/mol, XLogP of 7.74, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethenyl-2,3-difluorophenyl)-N,N-diphenylaniline is sourced from PubChem (CID 142698586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).