2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine

C13H11ClFNO — CID 86649742

IUPAC2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine
SMILESFc1cccc(CCOc2cccc(Cl)n2)c1
InChIInChI=1S/C13H11ClFNO/c14-12-5-2-6-13(16-12)17-8-7-10-3-1-4-11(15)9-10/h1-6,9H,7-8H2
InChIKeyPIIIUVUYCCPKPF-UHFFFAOYSA-N
MW251.69 g/mol
LogP3.50
Rot. Bonds4

About 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine

2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine (PubChem CID 86649742) has the molecular formula C13H11ClFNO and a molecular weight of 251.69 g/mol. Its IUPAC name is 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine.

Molecular Properties

Compound Name2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine
PubChem CID86649742
Molecular FormulaC13H11ClFNO
Molecular Weight251.69 g/mol
Exact Mass251.05
IUPAC Name2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine
SMILESFc1cccc(CCOc2cccc(Cl)n2)c1
InChIInChI=1S/C13H11ClFNO/c14-12-5-2-6-13(16-12)17-8-7-10-3-1-4-11(15)9-10/h1-6,9H,7-8H2
InChIKeyPIIIUVUYCCPKPF-UHFFFAOYSA-N
XLogP3.50
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.69
LogP ≤ 53.50
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

1,3-dichloro-2-[2-(3-fluorophenyl)ethoxy]benzene
CID 140972707
2-[(6-chloro-2-pyridinyl)oxy]ethanamine
CID 89179047
2-chloro-6-(2-phenoxyethoxy)pyridine
CID 55212397
4-chloro-2-[(3-fluorophenyl)methyl]pyrimidine
CID 61219333
2-(2-bromo-4-fluorophenoxy)-6-chloropyridine
CID 60725991
2-chloro-6-[2-(3-methoxypropoxy)ethoxy]pyridine
CID 103177517
2-(3-fluorophenyl)ethoxy-dimethoxysilane
CID 152766772
CID 90171486
CID 90171486
2-chloro-4-[3-(3-fluorophenyl)propoxy]phenol
CID 174367428
6-chloro-2-N-[2-(3-fluorophenyl)ethyl]pyridine-2,4-diamine
CID 104923773
6-chloro-N-[(3-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 62235425
3-[2-(3-fluorophenyl)ethoxy]propanoic acid
CID 59296248

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine?
The IUPAC name of 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine (CID 86649742) is 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine.
What is the SMILES notation for 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine?
The canonical SMILES for 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine is Fc1cccc(CCOc2cccc(Cl)n2)c1.
What is the InChIKey of 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine?
The InChIKey is PIIIUVUYCCPKPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClFNO/c14-12-5-2-6-13(16-12)17-8-7-10-3-1-4-11(15)9-10/h1-6,9H,7-8H2.
What are the key properties of 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine?
2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine has a molecular weight of 251.69 g/mol, XLogP of 3.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine is sourced from PubChem (CID 86649742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).