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

C12H9ClFNO — CID 175712271

IUPAC3-(3-chloro-4-fluorophenyl)-2-methoxypyridine
SMILESCOc1ncccc1-c1ccc(F)c(Cl)c1
InChIInChI=1S/C12H9ClFNO/c1-16-12-9(3-2-6-15-12)8-4-5-11(14)10(13)7-8/h2-7H,1H3
InChIKeyOGHACYAGYFELOB-UHFFFAOYSA-N
MW237.66 g/mol
LogP3.55
Rot. Bonds2

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

3-(3-chloro-4-fluorophenyl)-2-methoxypyridine (PubChem CID 175712271) has the molecular formula C12H9ClFNO and a molecular weight of 237.66 g/mol. Its IUPAC name is 3-(3-chloro-4-fluorophenyl)-2-methoxypyridine.

Molecular Properties

Compound Name3-(3-chloro-4-fluorophenyl)-2-methoxypyridine
PubChem CID175712271
Molecular FormulaC12H9ClFNO
Molecular Weight237.66 g/mol
Exact Mass237.04
IUPAC Name3-(3-chloro-4-fluorophenyl)-2-methoxypyridine
SMILESCOc1ncccc1-c1ccc(F)c(Cl)c1
InChIInChI=1S/C12H9ClFNO/c1-16-12-9(3-2-6-15-12)8-4-5-11(14)10(13)7-8/h2-7H,1H3
InChIKeyOGHACYAGYFELOB-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

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Related Compounds

2-[(3-Chlorophenyl)methoxy]-3-methyl-4-(piperidin-4-yl)pyridine
CID 25263326
2-[(1S)-1-(3-chlorophenyl)ethoxy]-3-methyl-4-(piperidin-4-yl)pyridine
CID 25263336
2-[(1R)-1-(3-chlorophenyl)ethoxy]-3-methyl-4-(piperidin-4-yl)pyridine
CID 25263337
2-[1-(3-Chlorophenyl)propoxy]-3-methyl-4-(piperidin-4-yl)pyridine
CID 25263338
2-[1-(3-Chlorophenyl)-2,2,2-trifluoroethoxy]-3-methyl-4-(piperidin-4-yl)pyridine
CID 25263339
3-(3-(3-Chlorobenzyloxy)-5-methylphenyl)pyridine
CID 44409820
2-(3,4-dichlorophenyl)-3,4-dihydro-2H-pyrano[2,3-b]pyridine
CID 514904
6-chloro-2-(4-chlorophenyl)-2H-pyrano[2,3-b]pyridine
CID 514907
1-Methoxyisoquinoline
CID 141052
(5R)-5-(4-chlorophenyl)-3-(6-methoxy-3-pyridinyl)cyclohex-2-en-1-one
CID 44143820
1-[4-(4-chloro-2-methylphenoxy)-3-pyridinyl]-N,N-dimethylmethanamine
CID 44449267
1-[4-(4-chloro-2-ethylphenoxy)-3-pyridinyl]-N,N-dimethylmethanamine
CID 44449272

Frequently Asked Questions

What is the IUPAC name of 3-(3-chloro-4-fluorophenyl)-2-methoxypyridine?
The IUPAC name of 3-(3-chloro-4-fluorophenyl)-2-methoxypyridine (CID 175712271) is 3-(3-chloro-4-fluorophenyl)-2-methoxypyridine.
What is the SMILES notation for 3-(3-chloro-4-fluorophenyl)-2-methoxypyridine?
The canonical SMILES for 3-(3-chloro-4-fluorophenyl)-2-methoxypyridine is COc1ncccc1-c1ccc(F)c(Cl)c1.
What is the InChIKey of 3-(3-chloro-4-fluorophenyl)-2-methoxypyridine?
The InChIKey is OGHACYAGYFELOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFNO/c1-16-12-9(3-2-6-15-12)8-4-5-11(14)10(13)7-8/h2-7H,1H3.
What are the key properties of 3-(3-chloro-4-fluorophenyl)-2-methoxypyridine?
3-(3-chloro-4-fluorophenyl)-2-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-(3-chloro-4-fluorophenyl)-2-methoxypyridine is sourced from PubChem (CID 175712271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).