pyridin-2-ylmethyl hypoiodite

C6H6INO — CID 67567753

IUPACpyridin-2-ylmethyl hypoiodite
SMILESIOCc1ccccn1
InChIInChI=1S/C6H6INO/c7-9-5-6-3-1-2-4-8-6/h1-4H,5H2
InChIKeyZQMOWRODIMXDDG-UHFFFAOYSA-N
MW235.02 g/mol
LogP1.95
Rot. Bonds2

About pyridin-2-ylmethyl hypoiodite

pyridin-2-ylmethyl hypoiodite (PubChem CID 67567753) has the molecular formula C6H6INO and a molecular weight of 235.02 g/mol. Its IUPAC name is pyridin-2-ylmethyl hypoiodite.

Molecular Properties

Compound Namepyridin-2-ylmethyl hypoiodite
PubChem CID67567753
Molecular FormulaC6H6INO
Molecular Weight235.02 g/mol
Exact Mass234.95
IUPAC Namepyridin-2-ylmethyl hypoiodite
SMILESIOCc1ccccn1
InChIInChI=1S/C6H6INO/c7-9-5-6-3-1-2-4-8-6/h1-4H,5H2
InChIKeyZQMOWRODIMXDDG-UHFFFAOYSA-N
XLogP1.95
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.02
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(pyridin-1-ium-4-yloxymethyl)pyridine
CID 59293395
N-(pyridin-2-ylmethoxy)methanamine
CID 58351102
2-(pyridin-4-yloxymethyl)pyridine
CID 58505689
2-(hydroxymethyl)-2-(pyridin-2-ylmethoxy)propane-1,3-diol
CID 150698152
2-(1,1-difluoroethoxymethyl)pyridine
CID 68641957
2-(pyridin-2-ylmethoxy)benzenethiol
CID 146174195
pyridin-2-ylmethyl 2-hydroxybenzoate
CID 43053918
trimethoxy(2-pyridin-2-ylethyl)silane
CID 158126739
carbanide;phosphane;bis(pyridin-2-ylmethylazanide);bis(ruthenium(2+));bis(yttrium)
CID 157165577
5-bromo-2-(pyridin-2-ylmethoxy)benzoic acid
CID 28981361
bis(2-[[26,27,28-tris(pyridin-2-ylmethoxy)-2,8,14,20-tetrathiapentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15,17,19(26),21,23-dodecaen-25-yl]oxymethyl]pyridine);dihydrate
CID 139160321
2-[(3,4-dichlorophenoxy)methyl]pyridine
CID 174779615

Frequently Asked Questions

What is the IUPAC name of pyridin-2-ylmethyl hypoiodite?
The IUPAC name of pyridin-2-ylmethyl hypoiodite (CID 67567753) is pyridin-2-ylmethyl hypoiodite.
What is the SMILES notation for pyridin-2-ylmethyl hypoiodite?
The canonical SMILES for pyridin-2-ylmethyl hypoiodite is IOCc1ccccn1.
What is the InChIKey of pyridin-2-ylmethyl hypoiodite?
The InChIKey is ZQMOWRODIMXDDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6INO/c7-9-5-6-3-1-2-4-8-6/h1-4H,5H2.
What are the key properties of pyridin-2-ylmethyl hypoiodite?
pyridin-2-ylmethyl hypoiodite has a molecular weight of 235.02 g/mol, XLogP of 1.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-2-ylmethyl hypoiodite is sourced from PubChem (CID 67567753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).