5-[(4-chlorophenyl)methoxy]-2-fluoropyridine

C12H9ClFNO — CID 115282951

IUPAC5-[(4-chlorophenyl)methoxy]-2-fluoropyridine
SMILESFc1ccc(OCc2ccc(Cl)cc2)cn1
InChIInChI=1S/C12H9ClFNO/c13-10-3-1-9(2-4-10)8-16-11-5-6-12(14)15-7-11/h1-7H,8H2
InChIKeyMCDBGJIROIRFTL-UHFFFAOYSA-N
MW237.66 g/mol
LogP3.45
Rot. Bonds3

About 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine

5-[(4-chlorophenyl)methoxy]-2-fluoropyridine (PubChem CID 115282951) has the molecular formula C12H9ClFNO and a molecular weight of 237.66 g/mol. Its IUPAC name is 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine.

Molecular Properties

Compound Name5-[(4-chlorophenyl)methoxy]-2-fluoropyridine
PubChem CID115282951
Molecular FormulaC12H9ClFNO
Molecular Weight237.66 g/mol
Exact Mass237.04
IUPAC Name5-[(4-chlorophenyl)methoxy]-2-fluoropyridine
SMILESFc1ccc(OCc2ccc(Cl)cc2)cn1
InChIInChI=1S/C12H9ClFNO/c13-10-3-1-9(2-4-10)8-16-11-5-6-12(14)15-7-11/h1-7H,8H2
InChIKeyMCDBGJIROIRFTL-UHFFFAOYSA-N
XLogP3.45
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.66
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(chloromethyl)-5-[(4-chlorophenyl)methoxy]pyridine
CID 79800294
5-[(4-chlorophenyl)methoxy]pyridine-2-carbothioamide
CID 115488934
5-[(2,3-difluorophenyl)methoxy]-2-fluoropyridine
CID 115371725
4-[(4-chlorophenyl)methoxy]-1,2-oxazole
CID 117233359
2-bromo-5-[(3,4-difluorophenyl)methoxy]pyridine
CID 103695236
1-[4-[(4-chlorophenyl)methoxy]phenyl]-N-[(4-fluorophenyl)methyl]methanamine;hydrochloride
CID 17292549
1-chloro-4-[(4-phenoxyphenoxy)methyl]benzene
CID 54171722
4-[(4-chlorophenyl)methoxy]benzene-1,2-diol
CID 139941742
1-benzyl-4-[(4-chlorophenyl)methoxy]benzene
CID 54328540
5-[(4-bromo-2-fluorophenyl)methoxy]-2-fluoropyridine
CID 115282947
[5-[(3,4-difluorophenyl)methoxy]-2-pyridinyl]methanol
CID 18758409
[4-[(3-chloro-4-fluorophenoxy)methyl]phenyl]methanamine
CID 63880371

Frequently Asked Questions

What is the IUPAC name of 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine?
The IUPAC name of 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine (CID 115282951) is 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine.
What is the SMILES notation for 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine?
The canonical SMILES for 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine is Fc1ccc(OCc2ccc(Cl)cc2)cn1.
What is the InChIKey of 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine?
The InChIKey is MCDBGJIROIRFTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFNO/c13-10-3-1-9(2-4-10)8-16-11-5-6-12(14)15-7-11/h1-7H,8H2.
What are the key properties of 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine?
5-[(4-chlorophenyl)methoxy]-2-fluoropyridine has a molecular weight of 237.66 g/mol, XLogP of 3.45, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-chlorophenyl)methoxy]-2-fluoropyridine is sourced from PubChem (CID 115282951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).