2-chloro-5-[(2-iodophenoxy)methyl]pyridine

C12H9ClINO — CID 43428206

IUPAC2-chloro-5-[(2-iodophenoxy)methyl]pyridine
SMILESClc1ccc(COc2ccccc2I)cn1
InChIInChI=1S/C12H9ClINO/c13-12-6-5-9(7-15-12)8-16-11-4-2-1-3-10(11)14/h1-7H,8H2
InChIKeyUKCVMCUXTFYOSY-UHFFFAOYSA-N
MW345.57 g/mol
LogP3.92
Rot. Bonds3

About 2-chloro-5-[(2-iodophenoxy)methyl]pyridine

2-chloro-5-[(2-iodophenoxy)methyl]pyridine (PubChem CID 43428206) has the molecular formula C12H9ClINO and a molecular weight of 345.57 g/mol. Its IUPAC name is 2-chloro-5-[(2-iodophenoxy)methyl]pyridine.

Molecular Properties

Compound Name2-chloro-5-[(2-iodophenoxy)methyl]pyridine
PubChem CID43428206
Molecular FormulaC12H9ClINO
Molecular Weight345.57 g/mol
Exact Mass344.94
IUPAC Name2-chloro-5-[(2-iodophenoxy)methyl]pyridine
SMILESClc1ccc(COc2ccccc2I)cn1
InChIInChI=1S/C12H9ClINO/c13-12-6-5-9(7-15-12)8-16-11-4-2-1-3-10(11)14/h1-7H,8H2
InChIKeyUKCVMCUXTFYOSY-UHFFFAOYSA-N
XLogP3.92
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.57
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[5-[(2-iodophenoxy)methyl]-2-pyridinyl]hydrazine
CID 62246023
2-chloro-5-(pyridin-2-yloxymethyl)pyridine
CID 131560661
3-chloro-6-[(2-iodophenoxy)methyl]pyridazine
CID 104514189
1-iodo-2-[(4-methylphenyl)methoxy]benzene
CID 63530114
5-[(1-bromonaphthalen-2-yl)oxymethyl]-2-chloropyridine
CID 63480626
2-chloro-5-[(2,6-dichlorophenoxy)methyl]pyridine
CID 54920974
1,2-bis[(2-iodophenoxy)methyl]benzene
CID 154951075
2-chloro-5-(methoxymethyl)pyridine
CID 19010921
2-chloro-5-[(2-chloro-5-methylphenoxy)methyl]pyridine
CID 43245470
(6-chloro-3-pyridinyl)methyl cyanate
CID 171428640
2-chloro-5-[(4-ethyl-2-methoxyphenoxy)methyl]pyridine
CID 103866434
4-[(6-chloro-3-pyridinyl)methoxy]aniline
CID 20537895

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[(2-iodophenoxy)methyl]pyridine?
The IUPAC name of 2-chloro-5-[(2-iodophenoxy)methyl]pyridine (CID 43428206) is 2-chloro-5-[(2-iodophenoxy)methyl]pyridine.
What is the SMILES notation for 2-chloro-5-[(2-iodophenoxy)methyl]pyridine?
The canonical SMILES for 2-chloro-5-[(2-iodophenoxy)methyl]pyridine is Clc1ccc(COc2ccccc2I)cn1.
What is the InChIKey of 2-chloro-5-[(2-iodophenoxy)methyl]pyridine?
The InChIKey is UKCVMCUXTFYOSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClINO/c13-12-6-5-9(7-15-12)8-16-11-4-2-1-3-10(11)14/h1-7H,8H2.
What are the key properties of 2-chloro-5-[(2-iodophenoxy)methyl]pyridine?
2-chloro-5-[(2-iodophenoxy)methyl]pyridine has a molecular weight of 345.57 g/mol, XLogP of 3.92, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[(2-iodophenoxy)methyl]pyridine is sourced from PubChem (CID 43428206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).