3-[(Z)-1-fluoro-2-iodoethenyl]pyridine

C7H5FIN — CID 163204264

IUPAC3-[(Z)-1-fluoro-2-iodoethenyl]pyridine
SMILESF/C(=C\I)c1cccnc1
InChIInChI=1S/C7H5FIN/c8-7(4-9)6-2-1-3-10-5-6/h1-5H/b7-4-
InChIKeyWVFIQNONURMBHR-DAXSKMNVSA-N
MW249.03 g/mol
LogP2.78
Rot. Bonds1

About 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine

3-[(Z)-1-fluoro-2-iodoethenyl]pyridine (PubChem CID 163204264) has the molecular formula C7H5FIN and a molecular weight of 249.03 g/mol. Its IUPAC name is 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine.

Molecular Properties

Compound Name3-[(Z)-1-fluoro-2-iodoethenyl]pyridine
PubChem CID163204264
Molecular FormulaC7H5FIN
Molecular Weight249.03 g/mol
Exact Mass248.95
IUPAC Name3-[(Z)-1-fluoro-2-iodoethenyl]pyridine
SMILESF/C(=C\I)c1cccnc1
InChIInChI=1S/C7H5FIN/c8-7(4-9)6-2-1-3-10-5-6/h1-5H/b7-4-
InChIKeyWVFIQNONURMBHR-DAXSKMNVSA-N
XLogP2.78
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.03
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

CID 157283677
CID 157283677
1-phenyl-2-pyridin-3-ylethane-1,2-dione
CID 10987556
CID 131854915
CID 131854915
nickel;pyridine-3-carboxylic acid
CID 174049937
3-[(Z)-2-fluoro-2-phenylethenyl]pyridine
CID 141385895
calcium;hydride;pyridine-3-carboxylic acid
CID 173013176
CID 175154223
CID 175154223
methane;pyridine-3-carboxamide
CID 19390506
3-[(Z)-but-2-en-2-yl]pyridine
CID 101055092
1-pyridin-3-ylethanone;hydrochloride
CID 69233376
neodymium(3+);pyridine-3-carboxylate
CID 23619365
bis(pyridine-3-carboxylate);ruthenium(2+)
CID 87535471

Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine?
The IUPAC name of 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine (CID 163204264) is 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine.
What is the SMILES notation for 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine?
The canonical SMILES for 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine is F/C(=C\I)c1cccnc1.
What is the InChIKey of 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine?
The InChIKey is WVFIQNONURMBHR-DAXSKMNVSA-N. The full InChI is InChI=1S/C7H5FIN/c8-7(4-9)6-2-1-3-10-5-6/h1-5H/b7-4-.
What are the key properties of 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine?
3-[(Z)-1-fluoro-2-iodoethenyl]pyridine has a molecular weight of 249.03 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-1-fluoro-2-iodoethenyl]pyridine is sourced from PubChem (CID 163204264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).