2-(fluoromethyl)-N,N-diphenylaniline

Name: 2-(fluoromethyl)-N,N-diphenylaniline — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₉H₁₆FN — CID 152695468

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

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 Name	2-(fluoromethyl)-N,N-diphenylaniline
PubChem CID	152695468
Molecular Formula	C₁₉H₁₆FN
Molecular Weight	277.34 g/mol
Exact Mass	277.13
IUPAC Name	2-(fluoromethyl)-N,N-diphenylaniline
SMILES	FCc1ccccc1N(c1ccccc1)c1ccccc1
InChI	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
InChIKey	ZQLHVFHTEJBRSZ-UHFFFAOYSA-N
XLogP	5.63
TPSA	3.24 Å²
H-Bond Donors
H-Bond Acceptors	1
Rotatable Bonds	4
Heavy Atoms	21
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	277.34
LogP ≤ 5	5.63
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

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).

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Sources

PubChem CID 152695468 — identifiers, structure, computed properties (public domain)

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