4-iodo-2-(1-methoxyethenyl)pyridine

C8H8INO — CID 121454369

IUPAC4-iodo-2-(1-methoxyethenyl)pyridine
SMILESC=C(OC)c1cc(I)ccn1
InChIInChI=1S/C8H8INO/c1-6(11-2)8-5-7(9)3-4-10-8/h3-5H,1H2,2H3
InChIKeyXUZHSCQLEYSEGJ-UHFFFAOYSA-N
MW261.06 g/mol
LogP2.30
Rot. Bonds2

About 4-iodo-2-(1-methoxyethenyl)pyridine

4-iodo-2-(1-methoxyethenyl)pyridine (PubChem CID 121454369) has the molecular formula C8H8INO and a molecular weight of 261.06 g/mol. Its IUPAC name is 4-iodo-2-(1-methoxyethenyl)pyridine.

Molecular Properties

Compound Name4-iodo-2-(1-methoxyethenyl)pyridine
PubChem CID121454369
Molecular FormulaC8H8INO
Molecular Weight261.06 g/mol
Exact Mass260.97
IUPAC Name4-iodo-2-(1-methoxyethenyl)pyridine
SMILESC=C(OC)c1cc(I)ccn1
InChIInChI=1S/C8H8INO/c1-6(11-2)8-5-7(9)3-4-10-8/h3-5H,1H2,2H3
InChIKeyXUZHSCQLEYSEGJ-UHFFFAOYSA-N
XLogP2.30
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.06
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-(1-methoxyethenyl)pyridin-4-amine
CID 177218237
methyl 2-(4-methoxy-2-pyridinyl)prop-2-enoate
CID 174428157
(4-iodo-2-pyridinyl)hydrazine
CID 53402897
ethene;methyl 4-aminopyridine-2-carboxylate
CID 177218086
2-(3,4-dimethoxyphenyl)-4-iodopyridine
CID 138723153
7-(1-methoxyethenyl)-5-methylimidazo[1,2-a]pyrimidine
CID 70297490
4-iodo-2-propoxypyridine
CID 66614410
methyl 4-methylpyridine-2-carboxylate
CID 10920693
methyl 4-dimethylphosphorylpyridine-2-carboxylate
CID 155970992
4-iodo-N-(1-methoxybutan-2-yl)pyridin-2-amine
CID 163875838
methyl 4-aminopyridine-2-carboxylate
CID 3759117
disodium;methyl 4-fluoropyridine-2-carboxylate;dichloride
CID 172849137

Frequently Asked Questions

What is the IUPAC name of 4-iodo-2-(1-methoxyethenyl)pyridine?
The IUPAC name of 4-iodo-2-(1-methoxyethenyl)pyridine (CID 121454369) is 4-iodo-2-(1-methoxyethenyl)pyridine.
What is the SMILES notation for 4-iodo-2-(1-methoxyethenyl)pyridine?
The canonical SMILES for 4-iodo-2-(1-methoxyethenyl)pyridine is C=C(OC)c1cc(I)ccn1.
What is the InChIKey of 4-iodo-2-(1-methoxyethenyl)pyridine?
The InChIKey is XUZHSCQLEYSEGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8INO/c1-6(11-2)8-5-7(9)3-4-10-8/h3-5H,1H2,2H3.
What are the key properties of 4-iodo-2-(1-methoxyethenyl)pyridine?
4-iodo-2-(1-methoxyethenyl)pyridine has a molecular weight of 261.06 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-iodo-2-(1-methoxyethenyl)pyridine is sourced from PubChem (CID 121454369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).