2-chloro-3-(methoxymethoxy)pyridine

C7H8ClNO2 — CID 57430080

IUPAC2-chloro-3-(methoxymethoxy)pyridine
SMILESCOCOc1cccnc1Cl
InChIInChI=1S/C7H8ClNO2/c1-10-5-11-6-3-2-4-9-7(6)8/h2-4H,5H2,1H3
InChIKeyKXLDXKULFBUWIT-UHFFFAOYSA-N
MW173.60 g/mol
LogP1.72
Rot. Bonds3

About 2-chloro-3-(methoxymethoxy)pyridine

2-chloro-3-(methoxymethoxy)pyridine (PubChem CID 57430080) has the molecular formula C7H8ClNO2 and a molecular weight of 173.60 g/mol. Its IUPAC name is 2-chloro-3-(methoxymethoxy)pyridine.

Molecular Properties

Compound Name2-chloro-3-(methoxymethoxy)pyridine
PubChem CID57430080
Molecular FormulaC7H8ClNO2
Molecular Weight173.60 g/mol
Exact Mass173.02
IUPAC Name2-chloro-3-(methoxymethoxy)pyridine
SMILESCOCOc1cccnc1Cl
InChIInChI=1S/C7H8ClNO2/c1-10-5-11-6-3-2-4-9-7(6)8/h2-4H,5H2,1H3
InChIKeyKXLDXKULFBUWIT-UHFFFAOYSA-N
XLogP1.72
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.60
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-chloro-3-(methoxymethoxy)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-ethyl-3-(methoxymethoxy)pyridine
CID 20598170
2-chloro-3-(2-fluoroethoxy)pyridine
CID 79035180
ethane;2-methoxy-3-(methoxymethoxy)pyridine
CID 144703127
2-chloro-3-(4-methylpentoxy)pyridine
CID 83157028
2-chloro-3-(2-ethylsulfanylethoxy)pyridine
CID 115646957
2-chloro-4-methoxy-3-(methoxymethoxy)pyridine
CID 102262534
2-chloro-3-(3-chloroprop-2-enoxy)pyridine
CID 77056049
3-butan-2-yloxy-2-chloropyridine
CID 65102026
2-chloro-3-[(5-chloro-1,3-dimethylpyrazol-4-yl)methoxy]pyridine
CID 115634537
CID 88918420
CID 88918420
2-chloro-3-[(4-iodophenyl)methoxy]pyridine
CID 65476581
2-bromo-1-chloro-3-(methoxymethoxy)benzene
CID 164894389

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-(methoxymethoxy)pyridine?
The IUPAC name of 2-chloro-3-(methoxymethoxy)pyridine (CID 57430080) is 2-chloro-3-(methoxymethoxy)pyridine.
What is the SMILES notation for 2-chloro-3-(methoxymethoxy)pyridine?
The canonical SMILES for 2-chloro-3-(methoxymethoxy)pyridine is COCOc1cccnc1Cl.
What is the InChIKey of 2-chloro-3-(methoxymethoxy)pyridine?
The InChIKey is KXLDXKULFBUWIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNO2/c1-10-5-11-6-3-2-4-9-7(6)8/h2-4H,5H2,1H3.
What are the key properties of 2-chloro-3-(methoxymethoxy)pyridine?
2-chloro-3-(methoxymethoxy)pyridine has a molecular weight of 173.60 g/mol, XLogP of 1.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-(methoxymethoxy)pyridine is sourced from PubChem (CID 57430080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).