2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine

C6H2ClF4NO — CID 119020397

IUPAC2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine
SMILESFc1cnc(Cl)c(OC(F)(F)F)c1
InChIInChI=1S/C6H2ClF4NO/c7-5-4(13-6(9,10)11)1-3(8)2-12-5/h1-2H
InChIKeyGVIKPZGLPDASPJ-UHFFFAOYSA-N
MW215.53 g/mol
LogP2.77
Rot. Bonds1

About 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine

2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine (PubChem CID 119020397) has the molecular formula C6H2ClF4NO and a molecular weight of 215.53 g/mol. Its IUPAC name is 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine.

Molecular Properties

Compound Name2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine
PubChem CID119020397
Molecular FormulaC6H2ClF4NO
Molecular Weight215.53 g/mol
Exact Mass214.98
IUPAC Name2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine
SMILESFc1cnc(Cl)c(OC(F)(F)F)c1
InChIInChI=1S/C6H2ClF4NO/c7-5-4(13-6(9,10)11)1-3(8)2-12-5/h1-2H
InChIKeyGVIKPZGLPDASPJ-UHFFFAOYSA-N
XLogP2.77
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.53
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-bromo-2,4-dichloro-5-(trifluoromethoxy)pyridine
CID 130093759
4-chloro-2-methyl-5-(trifluoromethoxy)pyridine
CID 70832767
2-chloro-3-(difluoromethyl)-5-(trifluoromethoxy)pyridin-4-amine
CID 118811897
2-chloro-5-fluoro-4-methyl-3-(trifluoromethoxy)pyridine
CID 119021842
2-chloro-5-[3-fluoro-4-(trifluoromethoxy)phenyl]-1,3-oxazole
CID 71226998
2,3,6-trichloro-4-(trifluoromethoxy)pyridine
CID 119007597
2-chloro-5-(trifluoromethoxy)pyridine-3-carbaldehyde
CID 119020600
3-fluoro-5-(trifluoromethoxy)pyridine
CID 91532712
3-chloro-5-fluoro-2-(trifluoromethyl)pyridine
CID 122706973
[6-chloro-4-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 130089748
2-chloro-5-(trifluoromethoxy)pyridine-4-carbaldehyde
CID 119019372
6-chloro-4-(trifluoromethoxy)pyridine-3-carbaldehyde
CID 119024459

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine?
The IUPAC name of 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine (CID 119020397) is 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine.
What is the SMILES notation for 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine?
The canonical SMILES for 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine is Fc1cnc(Cl)c(OC(F)(F)F)c1.
What is the InChIKey of 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine?
The InChIKey is GVIKPZGLPDASPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2ClF4NO/c7-5-4(13-6(9,10)11)1-3(8)2-12-5/h1-2H.
What are the key properties of 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine?
2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine has a molecular weight of 215.53 g/mol, XLogP of 2.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-fluoro-3-(trifluoromethoxy)pyridine is sourced from PubChem (CID 119020397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).