2-chloro-6-(2,2,2-trifluoroethoxy)pyridine

C7H5ClF3NO — CID 12760119

IUPAC2-chloro-6-(2,2,2-trifluoroethoxy)pyridine
SMILESFC(F)(F)COc1cccc(Cl)n1
InChIInChI=1S/C7H5ClF3NO/c8-5-2-1-3-6(12-5)13-4-7(9,10)11/h1-3H,4H2
InChIKeyNAMSUQXNPIXZQF-UHFFFAOYSA-N
MW211.57 g/mol
LogP2.68
Rot. Bonds2

About 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine

2-chloro-6-(2,2,2-trifluoroethoxy)pyridine (PubChem CID 12760119) has the molecular formula C7H5ClF3NO and a molecular weight of 211.57 g/mol. Its IUPAC name is 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine.

Molecular Properties

Compound Name2-chloro-6-(2,2,2-trifluoroethoxy)pyridine
PubChem CID12760119
Molecular FormulaC7H5ClF3NO
Molecular Weight211.57 g/mol
Exact Mass211.00
IUPAC Name2-chloro-6-(2,2,2-trifluoroethoxy)pyridine
SMILESFC(F)(F)COc1cccc(Cl)n1
InChIInChI=1S/C7H5ClF3NO/c8-5-2-1-3-6(12-5)13-4-7(9,10)11/h1-3H,4H2
InChIKeyNAMSUQXNPIXZQF-UHFFFAOYSA-N
XLogP2.68
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.57
LogP ≤ 52.68
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-(chloromethyl)-6-(2,2,2-trifluoroethoxy)pyridine
CID 62238846
2-methoxy-6-(2,2,2-trifluoroethoxy)pyridine
CID 154265042
2-phenyl-6-(2,2,2-trifluoroethoxy)pyridine
CID 135043638
2-[(6-chloro-2-pyridinyl)oxy]ethanamine
CID 89179047
N-tert-butyl-6-(2,2,2-trifluoroethoxy)pyridin-2-amine
CID 115498610
2-methyl-N-[[6-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]propan-2-amine
CID 62291181
2-chloro-6-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine
CID 112587541
2-piperidin-1-yl-6-(2,2,2-trifluoroethoxy)pyridine
CID 150915079
2-chloro-6-[2-(trifluoromethyl)phenoxy]pyridine
CID 63588771
2-chloro-6-(2-phenoxyethoxy)pyridine
CID 55212397
4-chloro-6-(2,2,2-trifluoroethoxy)pyrimidin-2-amine
CID 22104151
2-chloro-6-(2,3-dimethylbutoxy)pyridine
CID 141282553

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine?
The IUPAC name of 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine (CID 12760119) is 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine.
What is the SMILES notation for 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine?
The canonical SMILES for 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine is FC(F)(F)COc1cccc(Cl)n1.
What is the InChIKey of 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine?
The InChIKey is NAMSUQXNPIXZQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClF3NO/c8-5-2-1-3-6(12-5)13-4-7(9,10)11/h1-3H,4H2.
What are the key properties of 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine?
2-chloro-6-(2,2,2-trifluoroethoxy)pyridine has a molecular weight of 211.57 g/mol, XLogP of 2.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(2,2,2-trifluoroethoxy)pyridine is sourced from PubChem (CID 12760119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).