2-chloro-6-(2-phenoxyethoxy)pyridine

C13H12ClNO2 — CID 55212397

IUPAC2-chloro-6-(2-phenoxyethoxy)pyridine
SMILESClc1cccc(OCCOc2ccccc2)n1
InChIInChI=1S/C13H12ClNO2/c14-12-7-4-8-13(15-12)17-10-9-16-11-5-2-1-3-6-11/h1-8H,9-10H2
InChIKeyPRIRHSNQEQCBDP-UHFFFAOYSA-N
MW249.70 g/mol
LogP3.19
Rot. Bonds5

About 2-chloro-6-(2-phenoxyethoxy)pyridine

2-chloro-6-(2-phenoxyethoxy)pyridine (PubChem CID 55212397) has the molecular formula C13H12ClNO2 and a molecular weight of 249.70 g/mol. Its IUPAC name is 2-chloro-6-(2-phenoxyethoxy)pyridine.

Molecular Properties

Compound Name2-chloro-6-(2-phenoxyethoxy)pyridine
PubChem CID55212397
Molecular FormulaC13H12ClNO2
Molecular Weight249.70 g/mol
Exact Mass249.06
IUPAC Name2-chloro-6-(2-phenoxyethoxy)pyridine
SMILESClc1cccc(OCCOc2ccccc2)n1
InChIInChI=1S/C13H12ClNO2/c14-12-7-4-8-13(15-12)17-10-9-16-11-5-2-1-3-6-11/h1-8H,9-10H2
InChIKeyPRIRHSNQEQCBDP-UHFFFAOYSA-N
XLogP3.19
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.70
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-chloro-6-(2-phenoxyethoxy)pyridine 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

2-[(6-chloro-2-pyridinyl)oxy]ethanamine
CID 89179047
4-chloro-2-methyl-6-(2-phenoxyethoxy)pyrimidine
CID 62483754
2-chloro-6-[2-(2-methoxyethoxy)ethoxy]pyridine
CID 104561399
2-chloro-6-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine
CID 112587541
2-methoxy-6-[2-(4-phenoxyphenoxy)ethoxy]pyridine
CID 13386756
2-chloro-6-(2-phenoxyethoxy)-4-(trichloromethyl)pyridine
CID 21330009
2-chloro-6-[2-(3-methoxypropoxy)ethoxy]pyridine
CID 103177517
4-chloro-2-(4-chlorophenyl)-6-(2-phenoxyethoxy)pyrimidine
CID 54278545
2-chloro-6-(2,2,2-trifluoroethoxy)pyridine
CID 12760119
2-phenoxyethylmercury
CID 163598363
2-chloro-6-[2-(3-fluorophenyl)ethoxy]pyridine
CID 86649742
N-[[3-chloro-6-(2-phenoxyethoxy)-2-pyridinyl]methyl]ethanamine
CID 62292539

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(2-phenoxyethoxy)pyridine?
The IUPAC name of 2-chloro-6-(2-phenoxyethoxy)pyridine (CID 55212397) is 2-chloro-6-(2-phenoxyethoxy)pyridine.
What is the SMILES notation for 2-chloro-6-(2-phenoxyethoxy)pyridine?
The canonical SMILES for 2-chloro-6-(2-phenoxyethoxy)pyridine is Clc1cccc(OCCOc2ccccc2)n1.
What is the InChIKey of 2-chloro-6-(2-phenoxyethoxy)pyridine?
The InChIKey is PRIRHSNQEQCBDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO2/c14-12-7-4-8-13(15-12)17-10-9-16-11-5-2-1-3-6-11/h1-8H,9-10H2.
What are the key properties of 2-chloro-6-(2-phenoxyethoxy)pyridine?
2-chloro-6-(2-phenoxyethoxy)pyridine has a molecular weight of 249.70 g/mol, XLogP of 3.19, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(2-phenoxyethoxy)pyridine is sourced from PubChem (CID 55212397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).