2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine

C13H11ClFNO — CID 83269019

IUPAC2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine
SMILESCc1cnc(Cl)cc1OCc1ccccc1F
InChIInChI=1S/C13H11ClFNO/c1-9-7-16-13(14)6-12(9)17-8-10-4-2-3-5-11(10)15/h2-7H,8H2,1H3
InChIKeyHMALKGVPVGGVBV-UHFFFAOYSA-N
MW251.69 g/mol
LogP3.76
Rot. Bonds3

About 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine

2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine (PubChem CID 83269019) has the molecular formula C13H11ClFNO and a molecular weight of 251.69 g/mol. Its IUPAC name is 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine.

Molecular Properties

Compound Name2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine
PubChem CID83269019
Molecular FormulaC13H11ClFNO
Molecular Weight251.69 g/mol
Exact Mass251.05
IUPAC Name2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine
SMILESCc1cnc(Cl)cc1OCc1ccccc1F
InChIInChI=1S/C13H11ClFNO/c1-9-7-16-13(14)6-12(9)17-8-10-4-2-3-5-11(10)15/h2-7H,8H2,1H3
InChIKeyHMALKGVPVGGVBV-UHFFFAOYSA-N
XLogP3.76
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.69
LogP ≤ 53.76
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

2,4-dichloro-5-[(2-fluorophenoxy)methyl]pyridine
CID 116519330
2-chloro-4-[(2-fluorophenyl)methoxy]quinoline
CID 42597518
2-bromo-4-chloro-1-[(2-fluorophenyl)methoxy]benzene
CID 146003855
3,5-dichloro-4-[(2-fluorophenyl)methoxy]-2,6-dimethylpyridine
CID 134064703
2-chloro-6-[(2-fluorophenyl)methoxy]pyridin-4-amine
CID 114070689
1-fluoro-2-[(2-methylphenyl)methoxy]benzene
CID 60627765
2-[(2-fluorophenyl)methoxy]-5-methylaniline
CID 39247930
2-chloro-5-[(2-fluorophenoxy)methyl]pyrazine
CID 103054699
1-[(5-bromo-2-methylphenoxy)methyl]-2-chloro-3-fluorobenzene
CID 107284217
1-[4-[(2-fluorophenyl)methoxy]-3-pyridinyl]-N-methylmethanamine
CID 81251244
3-(chloromethyl)-4-[(2-fluorophenyl)methoxy]pyridine
CID 81235169
1-[3-chloro-4-[(2-fluorophenyl)methoxy]phenyl]ethanamine
CID 63937758

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine?
The IUPAC name of 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine (CID 83269019) is 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine.
What is the SMILES notation for 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine?
The canonical SMILES for 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine is Cc1cnc(Cl)cc1OCc1ccccc1F.
What is the InChIKey of 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine?
The InChIKey is HMALKGVPVGGVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClFNO/c1-9-7-16-13(14)6-12(9)17-8-10-4-2-3-5-11(10)15/h2-7H,8H2,1H3.
What are the key properties of 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine?
2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine has a molecular weight of 251.69 g/mol, XLogP of 3.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-[(2-fluorophenyl)methoxy]-5-methylpyridine is sourced from PubChem (CID 83269019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).