2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine

C8H9ClFNO — CID 171815314

IUPAC2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine
SMILESCOCCc1ccnc(Cl)c1F
InChIInChI=1S/C8H9ClFNO/c1-12-5-3-6-2-4-11-8(9)7(6)10/h2,4H,3,5H2,1H3
InChIKeyGCWLJLLLPYQOGX-UHFFFAOYSA-N
MW189.62 g/mol
LogP2.06
Rot. Bonds3

About 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine

2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine (PubChem CID 171815314) has the molecular formula C8H9ClFNO and a molecular weight of 189.62 g/mol. Its IUPAC name is 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine.

Molecular Properties

Compound Name2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine
PubChem CID171815314
Molecular FormulaC8H9ClFNO
Molecular Weight189.62 g/mol
Exact Mass189.04
IUPAC Name2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine
SMILESCOCCc1ccnc(Cl)c1F
InChIInChI=1S/C8H9ClFNO/c1-12-5-3-6-2-4-11-8(9)7(6)10/h2,4H,3,5H2,1H3
InChIKeyGCWLJLLLPYQOGX-UHFFFAOYSA-N
XLogP2.06
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.62
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-chloro-3-fluoro-4-(2-methoxyethyl)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

4-(chloromethyl)-3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine
CID 105383838
4-(chloromethyl)-N-ethyl-3-fluoro-N-(2-methoxyethyl)pyridin-2-amine
CID 105383537
3-(2-ethoxy-3-fluoro-4-pyridinyl)-N-(2-methoxyethyl)propan-1-amine
CID 114270472
2-chloro-4-(3-methoxypropoxy)-3-methylpyridine
CID 141469218
N-butan-2-yl-4-(chloromethyl)-3-fluoro-N-(2-methoxyethyl)pyridin-2-amine
CID 105383553
1-[5-(2-chloro-3-fluoro-4-pyridinyl)-2-(2-methoxyethyl)triazol-4-yl]ethanone
CID 170600186
2-chloro-3-fluoro-4-propan-2-yloxypyridine
CID 91620513
2-chloro-3-fluoro-4-propan-2-ylpyridine
CID 59849657
[3-fluoro-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4-pyridinyl]methanamine
CID 105391741
1-[2,3-difluoro-4-(2-methoxyethyl)phenyl]-2,3-difluoro-4-propoxybenzene
CID 90128779
2-chloro-4-methoxy-3-(methoxymethoxy)pyridine
CID 102262534
2,3-bis(2-methoxyethyl)pyrazine
CID 174840987

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine?
The IUPAC name of 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine (CID 171815314) is 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine.
What is the SMILES notation for 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine?
The canonical SMILES for 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine is COCCc1ccnc(Cl)c1F.
What is the InChIKey of 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine?
The InChIKey is GCWLJLLLPYQOGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClFNO/c1-12-5-3-6-2-4-11-8(9)7(6)10/h2,4H,3,5H2,1H3.
What are the key properties of 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine?
2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine has a molecular weight of 189.62 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-fluoro-4-(2-methoxyethyl)pyridine is sourced from PubChem (CID 171815314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).