2-(fluoromethyl)-N,N-diphenylaniline

C19H16FN — CID 152695468

IUPAC2-(fluoromethyl)-N,N-diphenylaniline
SMILESFCc1ccccc1N(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H16FN/c20-15-16-9-7-8-14-19(16)21(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14H,15H2
InChIKeyZQLHVFHTEJBRSZ-UHFFFAOYSA-N
MW277.34 g/mol
LogP5.63
Rot. Bonds4

About 2-(fluoromethyl)-N,N-diphenylaniline

2-(fluoromethyl)-N,N-diphenylaniline (PubChem CID 152695468) has the molecular formula C19H16FN and a molecular weight of 277.34 g/mol. Its IUPAC name is 2-(fluoromethyl)-N,N-diphenylaniline.

Molecular Properties

Compound Name2-(fluoromethyl)-N,N-diphenylaniline
PubChem CID152695468
Molecular FormulaC19H16FN
Molecular Weight277.34 g/mol
Exact Mass277.13
IUPAC Name2-(fluoromethyl)-N,N-diphenylaniline
SMILESFCc1ccccc1N(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H16FN/c20-15-16-9-7-8-14-19(16)21(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14H,15H2
InChIKeyZQLHVFHTEJBRSZ-UHFFFAOYSA-N
XLogP5.63
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500277.34
LogP ≤ 55.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,2-N-diphenyl-1-N,2-N-bis[4-(N-phenylanilino)phenyl]benzene-1,2-diamine
CID 24872736
N-phenyl-2-prop-2-enyl-N-[4-[4-(N-(2-prop-2-enylphenyl)anilino)phenyl]phenyl]aniline
CID 66634309
N,N-diphenylnaphthalen-1-amine
CID 11392281
2-[2-[diethoxy(methyl)silyl]ethyl]-N,N-diphenylaniline
CID 67559581
N,N-diphenyl-2-[2-[2-(N-phenylanilino)phenyl]ethynyl]aniline
CID 162514714
2-bromo-1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine
CID 170040263
1-N,4-N-dinaphthalen-1-yl-4-N-[4-[N-naphthalen-1-yl-4-(N-naphthalen-1-ylanilino)anilino]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 87744556
1-N-[4-[4-(N-naphthalen-1-ylanilino)-N-[4-(N-naphthalen-1-ylanilino)phenyl]anilino]phenyl]-1-N,4-N,4-N-tris[4-(N-naphthalen-1-ylanilino)phenyl]benzene-1,4-diamine
CID 122607218
4-N-naphthalen-1-yl-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
CID 22218375
N,N-diphenyl-2-[2-(N-phenylanilino)phenyl]sulfanylaniline
CID 175066969
N,N-diphenylaniline;silane
CID 131739129
2-chloro-3-fluoro-N,N-diphenylaniline
CID 163209826

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-N,N-diphenylaniline?
The IUPAC name of 2-(fluoromethyl)-N,N-diphenylaniline (CID 152695468) is 2-(fluoromethyl)-N,N-diphenylaniline.
What is the SMILES notation for 2-(fluoromethyl)-N,N-diphenylaniline?
The canonical SMILES for 2-(fluoromethyl)-N,N-diphenylaniline is FCc1ccccc1N(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(fluoromethyl)-N,N-diphenylaniline?
The InChIKey is ZQLHVFHTEJBRSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN/c20-15-16-9-7-8-14-19(16)21(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14H,15H2.
What are the key properties of 2-(fluoromethyl)-N,N-diphenylaniline?
2-(fluoromethyl)-N,N-diphenylaniline has a molecular weight of 277.34 g/mol, XLogP of 5.63, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-N,N-diphenylaniline is sourced from PubChem (CID 152695468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).