3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine

C16H10FIN2 — CID 46316518

IUPAC3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine
SMILESFc1cc(-c2cccnc2)cc(-c2ccncc2)c1I
InChIInChI=1S/C16H10FIN2/c17-15-9-13(12-2-1-5-20-10-12)8-14(16(15)18)11-3-6-19-7-4-11/h1-10H
InChIKeyHYQNSISOKDVWDJ-UHFFFAOYSA-N
MW376.17 g/mol
LogP4.55
Rot. Bonds2

About 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine

3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine (PubChem CID 46316518) has the molecular formula C16H10FIN2 and a molecular weight of 376.17 g/mol. Its IUPAC name is 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine.

Molecular Properties

Compound Name3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine
PubChem CID46316518
Molecular FormulaC16H10FIN2
Molecular Weight376.17 g/mol
Exact Mass375.99
IUPAC Name3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine
SMILESFc1cc(-c2cccnc2)cc(-c2ccncc2)c1I
InChIInChI=1S/C16H10FIN2/c17-15-9-13(12-2-1-5-20-10-12)8-14(16(15)18)11-3-6-19-7-4-11/h1-10H
InChIKeyHYQNSISOKDVWDJ-UHFFFAOYSA-N
XLogP4.55
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.17
LogP ≤ 54.55
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

3-(5-fluoro-2-iodo-3-pyridin-3-ylphenyl)pyridine
CID 46316519
3-(4-bromo-3,5-difluorophenyl)pyridine
CID 164533968
3-[3-[3-(3-pyridin-4-ylphenyl)-5-[3-(3-pyridin-3-ylphenyl)-5-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]pyridine
CID 51358299
3-(2-fluoro-3-pyridin-4-ylphenyl)pyridine
CID 46316510
4-(3-fluoro-2-iodophenyl)pyridine
CID 46317259
3-(2-fluoro-4-iodo-5-pyridin-3-ylphenyl)pyridine
CID 46316515
3-(3-pyridin-3-ylphenyl)pyridine;4-(3-pyridin-4-ylphenyl)pyridine
CID 158129947
5-[3,5-bis[3-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyrimidine;5-[3,5-bis[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]pyrimidine;5-[3,5-bis[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]pyrimidine
CID 165097309
5-[3-[3-[3-pyridin-3-yl-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyrimidine
CID 164785648
2,4-diphenyl-6-(3-pyridin-3-yl-5-pyridin-4-ylphenyl)pyridine
CID 118582495
2-fluoro-3-iodo-5-pyridin-3-ylpyridine
CID 46315687
3-(3,5-diphenylphenyl)pyridine
CID 141411458

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine?
The IUPAC name of 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine (CID 46316518) is 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine.
What is the SMILES notation for 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine?
The canonical SMILES for 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine is Fc1cc(-c2cccnc2)cc(-c2ccncc2)c1I.
What is the InChIKey of 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine?
The InChIKey is HYQNSISOKDVWDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FIN2/c17-15-9-13(12-2-1-5-20-10-12)8-14(16(15)18)11-3-6-19-7-4-11/h1-10H.
What are the key properties of 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine?
3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine has a molecular weight of 376.17 g/mol, XLogP of 4.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluoro-4-iodo-5-pyridin-4-ylphenyl)pyridine is sourced from PubChem (CID 46316518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).