5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride

C7H4ClF4NO3S — CID 131492748

IUPAC5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride
SMILESCc1ncc(F)c(S(=O)(=O)Cl)c1OC(F)(F)F
InChIInChI=1S/C7H4ClF4NO3S/c1-3-5(16-7(10,11)12)6(17(8,14)15)4(9)2-13-3/h2H,1H3
InChIKeyORYZQVBCEKKMCZ-UHFFFAOYSA-N
MW293.63 g/mol
LogP2.36
Rot. Bonds2

About 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride

5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride (PubChem CID 131492748) has the molecular formula C7H4ClF4NO3S and a molecular weight of 293.63 g/mol. Its IUPAC name is 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride.

Molecular Properties

Compound Name5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride
PubChem CID131492748
Molecular FormulaC7H4ClF4NO3S
Molecular Weight293.63 g/mol
Exact Mass292.95
IUPAC Name5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride
SMILESCc1ncc(F)c(S(=O)(=O)Cl)c1OC(F)(F)F
InChIInChI=1S/C7H4ClF4NO3S/c1-3-5(16-7(10,11)12)6(17(8,14)15)4(9)2-13-3/h2H,1H3
InChIKeyORYZQVBCEKKMCZ-UHFFFAOYSA-N
XLogP2.36
TPSA56.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.63
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride 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

5-iodo-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride
CID 131369998
4-bromo-6-methyl-5-(trifluoromethoxy)pyridine-3-sulfonyl chloride
CID 118822045
4-methoxy-2-methyl-5-(trifluoromethoxy)pyridine-3-sulfonyl chloride
CID 131319653
6-methyl-5-nitro-4-(trifluoromethoxy)pyridine-3-sulfonyl chloride
CID 134662373
4-(difluoromethyl)-5-fluoro-2-methylpyridine-3-sulfonyl chloride
CID 118823664
2-chloro-5-fluoro-4-methyl-3-(trifluoromethoxy)pyridine
CID 119021842
5-hydroxy-2-iodo-4-(trifluoromethoxy)pyridine-3-sulfonyl chloride
CID 131370169
4-methyl-5-nitro-2-(trifluoromethoxy)pyridine-3-sulfonyl chloride
CID 134671215
4-chloro-6-methyl-5-(trifluoromethoxy)pyridin-3-amine
CID 131119063
5-methyl-2-oxo-3-(trifluoromethoxy)-1H-pyridine-4-sulfonyl chloride
CID 131305685
5-methyl-2-oxo-4-(trifluoromethoxy)-1H-pyridine-3-sulfonyl chloride
CID 131305690
6-iodo-2-methyl-4-(trifluoromethoxy)pyridine-3-sulfonyl chloride
CID 131280044

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride?
The IUPAC name of 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride (CID 131492748) is 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride.
What is the SMILES notation for 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride?
The canonical SMILES for 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride is Cc1ncc(F)c(S(=O)(=O)Cl)c1OC(F)(F)F.
What is the InChIKey of 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride?
The InChIKey is ORYZQVBCEKKMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClF4NO3S/c1-3-5(16-7(10,11)12)6(17(8,14)15)4(9)2-13-3/h2H,1H3.
What are the key properties of 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride?
5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride has a molecular weight of 293.63 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methyl-3-(trifluoromethoxy)pyridine-4-sulfonyl chloride is sourced from PubChem (CID 131492748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).