3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine

C11H11Cl2N3O — CID 81346162

IUPAC3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine
SMILESCc1cc(Oc2ccc(Cl)c(CCl)n2)n(C)n1
InChIInChI=1S/C11H11Cl2N3O/c1-7-5-11(16(2)15-7)17-10-4-3-8(13)9(6-12)14-10/h3-5H,6H2,1-2H3
InChIKeyYWONIFKUONAFFD-UHFFFAOYSA-N
MW272.14 g/mol
LogP3.31
Rot. Bonds3

About 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine

3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine (PubChem CID 81346162) has the molecular formula C11H11Cl2N3O and a molecular weight of 272.14 g/mol. Its IUPAC name is 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine.

Molecular Properties

Compound Name3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine
PubChem CID81346162
Molecular FormulaC11H11Cl2N3O
Molecular Weight272.14 g/mol
Exact Mass271.03
IUPAC Name3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine
SMILESCc1cc(Oc2ccc(Cl)c(CCl)n2)n(C)n1
InChIInChI=1S/C11H11Cl2N3O/c1-7-5-11(16(2)15-7)17-10-4-3-8(13)9(6-12)14-10/h3-5H,6H2,1-2H3
InChIKeyYWONIFKUONAFFD-UHFFFAOYSA-N
XLogP3.31
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.14
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine 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-[(5-Chloro-2-pyridinyl)methoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 71813656
2-[(6-Chloro-2-pyridinyl)methoxy]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 71813658
2-(1-Methyl-3-trifluoromethylpyrazol-5-yloxy)-6-(aminomethyl)-pyridine
CID 11149948
2-(1-Methyl-3-trifluoromethylpyrazol-5-yloxy)-6-cyanopyridine
CID 11437094
2-Chloro-3-[4-chloro-5-(difluoromethoxy)-1-methylpyrazol-3-yl]-6-methoxypyridine
CID 11573363
2-Chloro-6-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridine-4-carbonitrile
CID 11822811
2-(1-Methyl-3-trifluoromethylpyrazol-5-yloxy)-6-(methylaminomethyl)-pyridine
CID 12009735
2-Chloro-4-methyl-6-(1-methyl-3-trifluoromethylpyrazol-5-yloxy)pyridine
CID 17980394
2-Fluoro-6-(1-methyl-3-trifluoromethylpyrazol-5-yloxy)pyridine
CID 17980398
2-(4-Chlorophenyl)-3,5-difluoro-4-methyl-6-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridine
CID 18359732
2-[(2-Chlorophenoxy)methyl]-6-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridine
CID 18974751
2-[(4-Chlorophenoxy)methyl]-6-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridine
CID 18974758

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine?
The IUPAC name of 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine (CID 81346162) is 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine.
What is the SMILES notation for 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine?
The canonical SMILES for 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine is Cc1cc(Oc2ccc(Cl)c(CCl)n2)n(C)n1.
What is the InChIKey of 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine?
The InChIKey is YWONIFKUONAFFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2N3O/c1-7-5-11(16(2)15-7)17-10-4-3-8(13)9(6-12)14-10/h3-5H,6H2,1-2H3.
What are the key properties of 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine?
3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine has a molecular weight of 272.14 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(chloromethyl)-6-(2,5-dimethylpyrazol-3-yl)oxypyridine is sourced from PubChem (CID 81346162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).