2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine

C13H9ClF3NO — CID 119004606

IUPAC2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine
SMILESCOc1cc(-c2ccccc2C(F)(F)F)cc(Cl)n1
InChIInChI=1S/C13H9ClF3NO/c1-19-12-7-8(6-11(14)18-12)9-4-2-3-5-10(9)13(15,16)17/h2-7H,1H3
InChIKeyGBRYLOIHHWYBLY-UHFFFAOYSA-N
MW287.67 g/mol
LogP4.43
Rot. Bonds2

About 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine

2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine (PubChem CID 119004606) has the molecular formula C13H9ClF3NO and a molecular weight of 287.67 g/mol. Its IUPAC name is 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine
PubChem CID119004606
Molecular FormulaC13H9ClF3NO
Molecular Weight287.67 g/mol
Exact Mass287.03
IUPAC Name2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine
SMILESCOc1cc(-c2ccccc2C(F)(F)F)cc(Cl)n1
InChIInChI=1S/C13H9ClF3NO/c1-19-12-7-8(6-11(14)18-12)9-4-2-3-5-10(9)13(15,16)17/h2-7H,1H3
InChIKeyGBRYLOIHHWYBLY-UHFFFAOYSA-N
XLogP4.43
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.67
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine
CID 119013717
2-fluoro-6-methoxy-3-[2-(trifluoromethyl)phenyl]pyridine
CID 133089531
4-methoxy-2,6-bis[2-(trifluoromethyl)phenyl]pyridine
CID 134618215
3-methoxy-5-[2-(trifluoromethyl)phenyl]pyridine
CID 134627152
5-fluoro-2-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine
CID 133089593
4-chloro-2-ethyl-6-[2-(trifluoromethyl)phenyl]pyrimidine
CID 80935852
1-[3-chloro-5-[2-(trifluoromethyl)phenyl]phenyl]ethanone
CID 118807758
2,3-dichloro-5-[2-(trifluoromethyl)phenyl]pyridine
CID 118815216
1-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]benzene
CID 3013906
4-chloro-2-propan-2-yl-6-[2-(trifluoromethyl)phenoxy]pyrimidine
CID 80944790
1,3-difluoro-2-(trifluoromethyl)-5-[2-(trifluoromethyl)phenyl]benzene
CID 118846513
2-chloro-6-(trifluoromethyl)-3-[2-(trifluoromethyl)phenyl]pyridine
CID 119019124

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine (CID 119004606) is 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine is COc1cc(-c2ccccc2C(F)(F)F)cc(Cl)n1.
What is the InChIKey of 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine?
The InChIKey is GBRYLOIHHWYBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClF3NO/c1-19-12-7-8(6-11(14)18-12)9-4-2-3-5-10(9)13(15,16)17/h2-7H,1H3.
What are the key properties of 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine?
2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine has a molecular weight of 287.67 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 119004606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).