N-(3-fluorophenyl)-3-phenylaniline

C18H14FN — CID 126702115

IUPACN-(3-fluorophenyl)-3-phenylaniline
SMILESFc1cccc(Nc2cccc(-c3ccccc3)c2)c1
InChIInChI=1S/C18H14FN/c19-16-9-5-11-18(13-16)20-17-10-4-8-15(12-17)14-6-2-1-3-7-14/h1-13,20H
InChIKeyAULTUWJMHOJRMH-UHFFFAOYSA-N
MW263.31 g/mol
LogP5.24
Rot. Bonds3

About N-(3-fluorophenyl)-3-phenylaniline

N-(3-fluorophenyl)-3-phenylaniline (PubChem CID 126702115) has the molecular formula C18H14FN and a molecular weight of 263.31 g/mol. Its IUPAC name is N-(3-fluorophenyl)-3-phenylaniline.

Molecular Properties

Compound NameN-(3-fluorophenyl)-3-phenylaniline
PubChem CID126702115
Molecular FormulaC18H14FN
Molecular Weight263.31 g/mol
Exact Mass263.11
IUPAC NameN-(3-fluorophenyl)-3-phenylaniline
SMILESFc1cccc(Nc2cccc(-c3ccccc3)c2)c1
InChIInChI=1S/C18H14FN/c19-16-9-5-11-18(13-16)20-17-10-4-8-15(12-17)14-6-2-1-3-7-14/h1-13,20H
InChIKeyAULTUWJMHOJRMH-UHFFFAOYSA-N
XLogP5.24
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500263.31
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-3-phenylaniline?
The IUPAC name of N-(3-fluorophenyl)-3-phenylaniline (CID 126702115) is N-(3-fluorophenyl)-3-phenylaniline.
What is the SMILES notation for N-(3-fluorophenyl)-3-phenylaniline?
The canonical SMILES for N-(3-fluorophenyl)-3-phenylaniline is Fc1cccc(Nc2cccc(-c3ccccc3)c2)c1.
What is the InChIKey of N-(3-fluorophenyl)-3-phenylaniline?
The InChIKey is AULTUWJMHOJRMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN/c19-16-9-5-11-18(13-16)20-17-10-4-8-15(12-17)14-6-2-1-3-7-14/h1-13,20H.
What are the key properties of N-(3-fluorophenyl)-3-phenylaniline?
N-(3-fluorophenyl)-3-phenylaniline has a molecular weight of 263.31 g/mol, XLogP of 5.24, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-3-phenylaniline is sourced from PubChem (CID 126702115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).