4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline

C25H20F2N2 — CID 14093519

IUPAC4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc(-c2cc(-c3ccc(F)cc3)nc(-c3ccc(F)cc3)c2)cc1
InChIInChI=1S/C25H20F2N2/c1-29(2)23-13-7-17(8-14-23)20-15-24(18-3-9-21(26)10-4-18)28-25(16-20)19-5-11-22(27)12-6-19/h3-16H,1-2H3
InChIKeyADDMZSGVSZGGRW-UHFFFAOYSA-N
MW386.45 g/mol
LogP6.43
Rot. Bonds4

About 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline

4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline (PubChem CID 14093519) has the molecular formula C25H20F2N2 and a molecular weight of 386.45 g/mol. Its IUPAC name is 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline
PubChem CID14093519
Molecular FormulaC25H20F2N2
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc(-c2cc(-c3ccc(F)cc3)nc(-c3ccc(F)cc3)c2)cc1
InChIInChI=1S/C25H20F2N2/c1-29(2)23-13-7-17(8-14-23)20-15-24(18-3-9-21(26)10-4-18)28-25(16-20)19-5-11-22(27)12-6-19/h3-16H,1-2H3
InChIKeyADDMZSGVSZGGRW-UHFFFAOYSA-N
XLogP6.43
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.45
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline?
The IUPAC name of 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline (CID 14093519) is 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline is CN(C)c1ccc(-c2cc(-c3ccc(F)cc3)nc(-c3ccc(F)cc3)c2)cc1.
What is the InChIKey of 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline?
The InChIKey is ADDMZSGVSZGGRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20F2N2/c1-29(2)23-13-7-17(8-14-23)20-15-24(18-3-9-21(26)10-4-18)28-25(16-20)19-5-11-22(27)12-6-19/h3-16H,1-2H3.
What are the key properties of 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline?
4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline has a molecular weight of 386.45 g/mol, XLogP of 6.43, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,6-bis(4-fluorophenyl)-4-pyridinyl]-N,N-dimethylaniline is sourced from PubChem (CID 14093519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).