3-(2-chloro-4-fluorophenyl)-5-methoxypyridine

C12H9ClFNO — CID 56702612

IUPAC3-(2-chloro-4-fluorophenyl)-5-methoxypyridine
SMILESCOc1cncc(-c2ccc(F)cc2Cl)c1
InChIInChI=1S/C12H9ClFNO/c1-16-10-4-8(6-15-7-10)11-3-2-9(14)5-12(11)13/h2-7H,1H3
InChIKeyKLWUDKZIOWFUQN-UHFFFAOYSA-N
MW237.66 g/mol
LogP3.55
Rot. Bonds2

About 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine

3-(2-chloro-4-fluorophenyl)-5-methoxypyridine (PubChem CID 56702612) has the molecular formula C12H9ClFNO and a molecular weight of 237.66 g/mol. Its IUPAC name is 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine.

Molecular Properties

Compound Name3-(2-chloro-4-fluorophenyl)-5-methoxypyridine
PubChem CID56702612
Molecular FormulaC12H9ClFNO
Molecular Weight237.66 g/mol
Exact Mass237.04
IUPAC Name3-(2-chloro-4-fluorophenyl)-5-methoxypyridine
SMILESCOc1cncc(-c2ccc(F)cc2Cl)c1
InChIInChI=1S/C12H9ClFNO/c1-16-10-4-8(6-15-7-10)11-3-2-9(14)5-12(11)13/h2-7H,1H3
InChIKeyKLWUDKZIOWFUQN-UHFFFAOYSA-N
XLogP3.55
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.66
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine 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-(Benzyloxy)-2-chloropyridine
CID 819374
5-phenyl-6-chloro-3-(2-(S)-azetidinylmethoxy)pyridine
CID 9839702
3-(4-Fluoro-phenyl)-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 15480242
3-(4-Chloro-phenyl)-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 15480243
3-(3-Chloro-4-fluoro-phenyl)-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 44372042
3-(2,4-Dichloro-phenyl)-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 44372043
7-(6-Chloro-5-methoxy-3-pyridinyl)-3-azabicyclo[3.3.1]non-6-ene
CID 71462524
2-Chloro-3-(4-chloro-phenyl)-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 9822806
3-[1-(2-Chloro-5-fluorophenyl)ethoxy]-5-phenylpyridin-2-amine
CID 146185154
2-Chloro-3-phenyl-5-((R)-pyrrolidin-3-yloxy)-pyridine
CID 44266489
2-Chloro-3-(3-chloro-phenyl)-5-((R)-pyrrolidin-3-yloxy)-pyridine
CID 44266548
3-(3-Chloro-phenyl)-5-((R)-pyrrolidin-3-yloxy)-pyridine
CID 44266554

Frequently Asked Questions

What is the IUPAC name of 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine?
The IUPAC name of 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine (CID 56702612) is 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine.
What is the SMILES notation for 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine?
The canonical SMILES for 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine is COc1cncc(-c2ccc(F)cc2Cl)c1.
What is the InChIKey of 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine?
The InChIKey is KLWUDKZIOWFUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFNO/c1-16-10-4-8(6-15-7-10)11-3-2-9(14)5-12(11)13/h2-7H,1H3.
What are the key properties of 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine?
3-(2-chloro-4-fluorophenyl)-5-methoxypyridine has a molecular weight of 237.66 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chloro-4-fluorophenyl)-5-methoxypyridine is sourced from PubChem (CID 56702612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).