5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine

C13H11Cl2NO — CID 61255794

IUPAC5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine
SMILESClCc1ccc(OCc2ccccc2Cl)nc1
InChIInChI=1S/C13H11Cl2NO/c14-7-10-5-6-13(16-8-10)17-9-11-3-1-2-4-12(11)15/h1-6,8H,7,9H2
InChIKeySPMBRVNYZKQZFF-UHFFFAOYSA-N
MW268.14 g/mol
LogP4.05
Rot. Bonds4

About 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine

5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine (PubChem CID 61255794) has the molecular formula C13H11Cl2NO and a molecular weight of 268.14 g/mol. Its IUPAC name is 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine.

Molecular Properties

Compound Name5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine
PubChem CID61255794
Molecular FormulaC13H11Cl2NO
Molecular Weight268.14 g/mol
Exact Mass267.02
IUPAC Name5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine
SMILESClCc1ccc(OCc2ccccc2Cl)nc1
InChIInChI=1S/C13H11Cl2NO/c14-7-10-5-6-13(16-8-10)17-9-11-3-1-2-4-12(11)15/h1-6,8H,7,9H2
InChIKeySPMBRVNYZKQZFF-UHFFFAOYSA-N
XLogP4.05
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.14
LogP ≤ 54.05
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

5-(chloromethyl)-2-ethoxypyridine
CID 10535190
1-chloro-2-[[3-(chloromethyl)phenoxy]methyl]benzene
CID 29299545
5-(chloromethyl)-2-ethoxypyridine;hydrochloride
CID 21271667
2-(2-chlorophenoxy)-5-[(2-chlorophenyl)methoxy]pyridine
CID 141305144
1,4-bis[(2-chlorophenyl)methoxy]benzene
CID 18515510
1-[5-chloro-2-[(2-chlorophenyl)methoxy]-4-pyridinyl]-N-methylmethanamine
CID 114927670
[6-[(2-bromophenyl)methoxy]-3-pyridinyl]methanamine
CID 82828442
3-[(2-chlorophenyl)methoxy]-1H-pyridazin-6-one
CID 13157421
5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]-1,3-dimethoxybenzene
CID 43516801
5-bromo-2-[(2-chlorophenyl)methoxy]pyrimidine
CID 63866925
4-chloro-6-[(2-chlorophenyl)methoxy]-2-methylsulfanylpyrimidine
CID 80544536
[6-[[2-(trifluoromethyl)phenyl]methoxy]-3-pyridinyl]methanol
CID 68755731

Frequently Asked Questions

What is the IUPAC name of 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine?
The IUPAC name of 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine (CID 61255794) is 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine.
What is the SMILES notation for 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine?
The canonical SMILES for 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine is ClCc1ccc(OCc2ccccc2Cl)nc1.
What is the InChIKey of 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine?
The InChIKey is SPMBRVNYZKQZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2NO/c14-7-10-5-6-13(16-8-10)17-9-11-3-1-2-4-12(11)15/h1-6,8H,7,9H2.
What are the key properties of 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine?
5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine has a molecular weight of 268.14 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(chloromethyl)-2-[(2-chlorophenyl)methoxy]pyridine is sourced from PubChem (CID 61255794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).