3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine

C12H6Cl2F3N — CID 134623597

IUPAC3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1ccccc1-c1ncc(Cl)cc1Cl
InChIInChI=1S/C12H6Cl2F3N/c13-7-5-10(14)11(18-6-7)8-3-1-2-4-9(8)12(15,16)17/h1-6H
InChIKeyNTQCRJJVVWCVTK-UHFFFAOYSA-N
MW292.09 g/mol
LogP5.07
Rot. Bonds1

About 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine

3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine (PubChem CID 134623597) has the molecular formula C12H6Cl2F3N and a molecular weight of 292.09 g/mol. Its IUPAC name is 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine
PubChem CID134623597
Molecular FormulaC12H6Cl2F3N
Molecular Weight292.09 g/mol
Exact Mass290.98
IUPAC Name3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1ccccc1-c1ncc(Cl)cc1Cl
InChIInChI=1S/C12H6Cl2F3N/c13-7-5-10(14)11(18-6-7)8-3-1-2-4-9(8)12(15,16)17/h1-6H
InChIKeyNTQCRJJVVWCVTK-UHFFFAOYSA-N
XLogP5.07
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.09
LogP ≤ 55.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-dichloro-5-[2-(trifluoromethyl)phenyl]pyridine
CID 118815216
2,5-bis[2-(trifluoromethyl)phenyl]pyridin-3-amine
CID 134624057
5-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]pyridin-3-ol
CID 133092047
5,6-bis[2-(trifluoromethyl)phenyl]pyridine-3-carboxylic acid
CID 134629102
methyl 5-chloro-3-[2-(trifluoromethyl)phenyl]pyridine-2-carboxylate
CID 134635499
2-[3,5-dichloro-2-[2-(trifluoromethyl)phenyl]-4-pyridinyl]acetic acid
CID 134623598
1-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]benzene
CID 3013906
2-chloro-5-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
CID 118998520
[5-amino-2-[2-(trifluoromethyl)phenyl]-3-pyridinyl]methanol
CID 134629150
5-fluoro-2-[2-(trifluoromethyl)phenyl]pyridine-3-carboxylic acid
CID 133089659
5-chloro-2-[2-(trifluoromethyl)phenyl]-1,3-oxazole
CID 117258904
2-chloro-5-[2-(trifluoromethyl)phenyl]-1,3-oxazole
CID 71227633

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine (CID 134623597) is 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine is FC(F)(F)c1ccccc1-c1ncc(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine?
The InChIKey is NTQCRJJVVWCVTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2F3N/c13-7-5-10(14)11(18-6-7)8-3-1-2-4-9(8)12(15,16)17/h1-6H.
What are the key properties of 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine?
3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine has a molecular weight of 292.09 g/mol, XLogP of 5.07, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-2-[2-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 134623597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).