4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine

C19H10F7N — CID 133089510

IUPAC4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine
SMILESFc1c(-c2ccccc2C(F)(F)F)cncc1-c1ccccc1C(F)(F)F
InChIInChI=1S/C19H10F7N/c20-17-13(11-5-1-3-7-15(11)18(21,22)23)9-27-10-14(17)12-6-2-4-8-16(12)19(24,25)26/h1-10H
InChIKeyVROSWBHMEDJHED-UHFFFAOYSA-N
MW385.28 g/mol
LogP6.59
Rot. Bonds2

About 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine

4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine (PubChem CID 133089510) has the molecular formula C19H10F7N and a molecular weight of 385.28 g/mol. Its IUPAC name is 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine
PubChem CID133089510
Molecular FormulaC19H10F7N
Molecular Weight385.28 g/mol
Exact Mass385.07
IUPAC Name4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine
SMILESFc1c(-c2ccccc2C(F)(F)F)cncc1-c1ccccc1C(F)(F)F
InChIInChI=1S/C19H10F7N/c20-17-13(11-5-1-3-7-15(11)18(21,22)23)9-27-10-14(17)12-6-2-4-8-16(12)19(24,25)26/h1-10H
InChIKeyVROSWBHMEDJHED-UHFFFAOYSA-N
XLogP6.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.28
LogP ≤ 56.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]benzene
CID 3013906
3-chloro-5-[2-(trifluoromethyl)phenyl]pyridine-4-carboxylic acid
CID 134626264
1,2,3,4-tetrafluoro-5-[2-(trifluoromethyl)phenyl]benzene
CID 134617391
2-chloro-3-fluoro-4-[2-(trifluoromethyl)phenyl]pyridine
CID 118997710
2-fluoro-5-(trifluoromethyl)-3-[2-(trifluoromethyl)phenyl]pyridine
CID 133089831
[2-fluoro-3-[2-(trifluoromethyl)phenyl]phenyl]methanamine
CID 134631455
1,3-difluoro-2-[2-(trifluoromethyl)phenyl]benzene
CID 118991852
4,5-difluoro-2-[2-(trifluoromethyl)phenyl]phenol
CID 118823457
1,2,4,5-tetrafluoro-3-methyl-6-[2-(trifluoromethyl)phenyl]benzene
CID 134628456
1-fluoro-2-methyl-3-[2-(trifluoromethyl)phenyl]benzene
CID 134626767
[5-[2-(trifluoromethyl)phenyl]-3-pyridinyl]methanamine
CID 71301549
3-methoxy-5-[2-(trifluoromethyl)phenyl]pyridine
CID 134627152

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine (CID 133089510) is 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine is Fc1c(-c2ccccc2C(F)(F)F)cncc1-c1ccccc1C(F)(F)F.
What is the InChIKey of 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine?
The InChIKey is VROSWBHMEDJHED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H10F7N/c20-17-13(11-5-1-3-7-15(11)18(21,22)23)9-27-10-14(17)12-6-2-4-8-16(12)19(24,25)26/h1-10H.
What are the key properties of 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine?
4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine has a molecular weight of 385.28 g/mol, XLogP of 6.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3,5-bis[2-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 133089510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).