3-(2-fluorophenyl)-N,5-dimethylaniline

C14H14FN — CID 126670489

IUPAC3-(2-fluorophenyl)-N,5-dimethylaniline
SMILESCNc1cc(C)cc(-c2ccccc2F)c1
InChIInChI=1S/C14H14FN/c1-10-7-11(9-12(8-10)16-2)13-5-3-4-6-14(13)15/h3-9,16H,1-2H3
InChIKeyBFQRNHBZOMGVTM-UHFFFAOYSA-N
MW215.27 g/mol
LogP3.84
Rot. Bonds2

About 3-(2-fluorophenyl)-N,5-dimethylaniline

3-(2-fluorophenyl)-N,5-dimethylaniline (PubChem CID 126670489) has the molecular formula C14H14FN and a molecular weight of 215.27 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N,5-dimethylaniline.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N,5-dimethylaniline
PubChem CID126670489
Molecular FormulaC14H14FN
Molecular Weight215.27 g/mol
Exact Mass215.11
IUPAC Name3-(2-fluorophenyl)-N,5-dimethylaniline
SMILESCNc1cc(C)cc(-c2ccccc2F)c1
InChIInChI=1S/C14H14FN/c1-10-7-11(9-12(8-10)16-2)13-5-3-4-6-14(13)15/h3-9,16H,1-2H3
InChIKeyBFQRNHBZOMGVTM-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.27
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(2-fluorophenyl)-N,5-dimethylaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N,5-dimethylaniline?
The IUPAC name of 3-(2-fluorophenyl)-N,5-dimethylaniline (CID 126670489) is 3-(2-fluorophenyl)-N,5-dimethylaniline.
What is the SMILES notation for 3-(2-fluorophenyl)-N,5-dimethylaniline?
The canonical SMILES for 3-(2-fluorophenyl)-N,5-dimethylaniline is CNc1cc(C)cc(-c2ccccc2F)c1.
What is the InChIKey of 3-(2-fluorophenyl)-N,5-dimethylaniline?
The InChIKey is BFQRNHBZOMGVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN/c1-10-7-11(9-12(8-10)16-2)13-5-3-4-6-14(13)15/h3-9,16H,1-2H3.
What are the key properties of 3-(2-fluorophenyl)-N,5-dimethylaniline?
3-(2-fluorophenyl)-N,5-dimethylaniline has a molecular weight of 215.27 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N,5-dimethylaniline is sourced from PubChem (CID 126670489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).