2-chloro-4-(difluoromethyl)-3,5-difluoropyridine

C6H2ClF4N — CID 130099578

IUPAC2-chloro-4-(difluoromethyl)-3,5-difluoropyridine
SMILESFc1cnc(Cl)c(F)c1C(F)F
InChIInChI=1S/C6H2ClF4N/c7-5-4(9)3(6(10)11)2(8)1-12-5/h1,6H
InChIKeyUVCQVOCPIUXLTI-UHFFFAOYSA-N
MW199.53 g/mol
LogP2.95
Rot. Bonds1

About 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine

2-chloro-4-(difluoromethyl)-3,5-difluoropyridine (PubChem CID 130099578) has the molecular formula C6H2ClF4N and a molecular weight of 199.53 g/mol. Its IUPAC name is 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine.

Molecular Properties

Compound Name2-chloro-4-(difluoromethyl)-3,5-difluoropyridine
PubChem CID130099578
Molecular FormulaC6H2ClF4N
Molecular Weight199.53 g/mol
Exact Mass198.98
IUPAC Name2-chloro-4-(difluoromethyl)-3,5-difluoropyridine
SMILESFc1cnc(Cl)c(F)c1C(F)F
InChIInChI=1S/C6H2ClF4N/c7-5-4(9)3(6(10)11)2(8)1-12-5/h1,6H
InChIKeyUVCQVOCPIUXLTI-UHFFFAOYSA-N
XLogP2.95
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.53
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine 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

2-chloro-3,4,5-trifluoropyridine
CID 18698768
6-chloro-4-(difluoromethyl)-5-fluoropyridine-3-carbonyl chloride
CID 130072079
6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol
CID 118998226
[4-(difluoromethyl)-3,5-difluoro-2-pyridinyl]methanamine
CID 130099744
2-chloro-3-(difluoromethyl)-4-fluoro-5-methoxypyridine
CID 119010666
3-chloro-4-(difluoromethyl)-5-fluoro-2-methoxypyridine
CID 130071589
4-(difluoromethyl)-2,5-difluoropyridine-3-carbaldehyde
CID 119011555
2-(bromomethyl)-4-chloro-3-(difluoromethyl)-5-fluoropyridine
CID 118855098
2-bromo-3-(chloromethyl)-4-(difluoromethyl)-5-fluoropyridine
CID 119025086
3-bromo-2-chloro-4-(difluoromethyl)-5-iodopyridine
CID 130107872
6-chloro-4-(difluoromethyl)-5-methylpyridin-3-ol
CID 119014799
5-bromo-2-chloro-3-(difluoromethyl)pyridine-4-sulfonyl chloride
CID 130108482

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine?
The IUPAC name of 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine (CID 130099578) is 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine.
What is the SMILES notation for 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine?
The canonical SMILES for 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine is Fc1cnc(Cl)c(F)c1C(F)F.
What is the InChIKey of 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine?
The InChIKey is UVCQVOCPIUXLTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2ClF4N/c7-5-4(9)3(6(10)11)2(8)1-12-5/h1,6H.
What are the key properties of 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine?
2-chloro-4-(difluoromethyl)-3,5-difluoropyridine has a molecular weight of 199.53 g/mol, XLogP of 2.95, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(difluoromethyl)-3,5-difluoropyridine is sourced from PubChem (CID 130099578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).