3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine

C14H13Cl2NO — CID 63446192

IUPAC3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine
SMILESCc1cccc(Oc2ccc(Cl)c(CCl)n2)c1C
InChIInChI=1S/C14H13Cl2NO/c1-9-4-3-5-13(10(9)2)18-14-7-6-11(16)12(8-15)17-14/h3-7H,8H2,1-2H3
InChIKeyGMBBZNVVOAZMDP-UHFFFAOYSA-N
MW282.17 g/mol
LogP4.88
Rot. Bonds3

About 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine

3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine (PubChem CID 63446192) has the molecular formula C14H13Cl2NO and a molecular weight of 282.17 g/mol. Its IUPAC name is 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine.

Molecular Properties

Compound Name3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine
PubChem CID63446192
Molecular FormulaC14H13Cl2NO
Molecular Weight282.17 g/mol
Exact Mass281.04
IUPAC Name3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine
SMILESCc1cccc(Oc2ccc(Cl)c(CCl)n2)c1C
InChIInChI=1S/C14H13Cl2NO/c1-9-4-3-5-13(10(9)2)18-14-7-6-11(16)12(8-15)17-14/h3-7H,8H2,1-2H3
InChIKeyGMBBZNVVOAZMDP-UHFFFAOYSA-N
XLogP4.88
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.17
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-2-(chloromethyl)-6-(2-fluorophenoxy)pyridine
CID 61267319
3-chloro-2-(chloromethyl)-6-(2-propoxyphenoxy)pyridine
CID 61268786
3-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridazine
CID 61268428
6-(2-tert-butyl-4-methylphenoxy)-3-chloro-2-(chloromethyl)pyridine
CID 63446405
6-(3-tert-butylphenoxy)-3-chloro-2-(chloromethyl)pyridine
CID 63446809
2-bromo-6-(2,3-dimethylphenoxy)pyridine
CID 63961920
3-chloro-2-(chloromethyl)-6-(3,4-dichlorophenoxy)pyridine
CID 63446768
2-chloro-4-(2,3-dimethylphenoxy)-6-methylpyrimidine
CID 62477434
3-chloro-2-(chloromethyl)-6-[(1-methyl-1,2,4-triazol-3-yl)oxy]pyridine
CID 106597658
4-(chloromethyl)-2-(2,3-dimethylphenoxy)quinoline
CID 63446236
3-chloro-2-(chloromethyl)-6-propan-2-yloxypyridine
CID 61267668
1-(3-chloro-6-naphthalen-1-yloxy-2-pyridinyl)-N-methylmethanamine
CID 62322004

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine?
The IUPAC name of 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine (CID 63446192) is 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine.
What is the SMILES notation for 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine?
The canonical SMILES for 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine is Cc1cccc(Oc2ccc(Cl)c(CCl)n2)c1C.
What is the InChIKey of 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine?
The InChIKey is GMBBZNVVOAZMDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO/c1-9-4-3-5-13(10(9)2)18-14-7-6-11(16)12(8-15)17-14/h3-7H,8H2,1-2H3.
What are the key properties of 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine?
3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine has a molecular weight of 282.17 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(chloromethyl)-6-(2,3-dimethylphenoxy)pyridine is sourced from PubChem (CID 63446192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).