3,5-dichloro-2,6-difluoro-4-methylpyridine

C6H3Cl2F2N — CID 54345490

IUPAC3,5-dichloro-2,6-difluoro-4-methylpyridine
SMILESCc1c(Cl)c(F)nc(F)c1Cl
InChIInChI=1S/C6H3Cl2F2N/c1-2-3(7)5(9)11-6(10)4(2)8/h1H3
InChIKeyAEQZLGOQOKWZJK-UHFFFAOYSA-N
MW198.00 g/mol
LogP2.98
Rot. Bonds

About 3,5-dichloro-2,6-difluoro-4-methylpyridine

3,5-dichloro-2,6-difluoro-4-methylpyridine (PubChem CID 54345490) has the molecular formula C6H3Cl2F2N and a molecular weight of 198.00 g/mol. Its IUPAC name is 3,5-dichloro-2,6-difluoro-4-methylpyridine.

Molecular Properties

Compound Name3,5-dichloro-2,6-difluoro-4-methylpyridine
PubChem CID54345490
Molecular FormulaC6H3Cl2F2N
Molecular Weight198.00 g/mol
Exact Mass196.96
IUPAC Name3,5-dichloro-2,6-difluoro-4-methylpyridine
SMILESCc1c(Cl)c(F)nc(F)c1Cl
InChIInChI=1S/C6H3Cl2F2N/c1-2-3(7)5(9)11-6(10)4(2)8/h1H3
InChIKeyAEQZLGOQOKWZJK-UHFFFAOYSA-N
XLogP2.98
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.00
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-2,6-difluoropyridine-3,4-diamine
CID 22284051
5-chloro-2,4,6-trifluoropyrimidine;methane
CID 162065377
4-chloro-2,6-difluoro-5-methylpyrimidine
CID 18981191
2,3,6-trifluoro-4,5-dimethylpyridine
CID 20792086
ethane;2,3,4,6-tetrafluoro-5-methylpyridine
CID 170619957
2,3,5,6-tetrafluoro-4-(2,3,4,5,6-pentachlorophenyl)pyridine
CID 133090102
5-chloro-3,4,6-trifluoro-N,N-dimethylpyridin-2-amine
CID 23234820
1-chloro-2,3,6-trifluoro-4,5-dimethylbenzene
CID 175248816
4-chloro-2-ethyl-6-fluoro-5-methylpyrimidine
CID 143740717
3-chloro-4-(3,5-dichlorophenyl)-2,5,6-trifluoropyridine
CID 133090436
5-chloro-4,6-difluoro-1H-pyrimidin-2-one
CID 118548236
3-chloro-4-(2,6-dichlorophenyl)-2,5,6-trifluoropyridine
CID 133090476

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-2,6-difluoro-4-methylpyridine?
The IUPAC name of 3,5-dichloro-2,6-difluoro-4-methylpyridine (CID 54345490) is 3,5-dichloro-2,6-difluoro-4-methylpyridine.
What is the SMILES notation for 3,5-dichloro-2,6-difluoro-4-methylpyridine?
The canonical SMILES for 3,5-dichloro-2,6-difluoro-4-methylpyridine is Cc1c(Cl)c(F)nc(F)c1Cl.
What is the InChIKey of 3,5-dichloro-2,6-difluoro-4-methylpyridine?
The InChIKey is AEQZLGOQOKWZJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3Cl2F2N/c1-2-3(7)5(9)11-6(10)4(2)8/h1H3.
What are the key properties of 3,5-dichloro-2,6-difluoro-4-methylpyridine?
3,5-dichloro-2,6-difluoro-4-methylpyridine has a molecular weight of 198.00 g/mol, XLogP of 2.98, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-2,6-difluoro-4-methylpyridine is sourced from PubChem (CID 54345490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).