3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine

C10H5ClFIN2 — CID 102169164

IUPAC3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine
SMILESFc1ccc(-c2ccnc(I)c2Cl)cn1
InChIInChI=1S/C10H5ClFIN2/c11-9-7(3-4-14-10(9)13)6-1-2-8(12)15-5-6/h1-5H
InChIKeyDZRYHFGMAHHGOF-UHFFFAOYSA-N
MW334.52 g/mol
LogP3.54
Rot. Bonds1

About 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine

3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine (PubChem CID 102169164) has the molecular formula C10H5ClFIN2 and a molecular weight of 334.52 g/mol. Its IUPAC name is 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine.

Molecular Properties

Compound Name3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine
PubChem CID102169164
Molecular FormulaC10H5ClFIN2
Molecular Weight334.52 g/mol
Exact Mass333.92
IUPAC Name3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine
SMILESFc1ccc(-c2ccnc(I)c2Cl)cn1
InChIInChI=1S/C10H5ClFIN2/c11-9-7(3-4-14-10(9)13)6-1-2-8(12)15-5-6/h1-5H
InChIKeyDZRYHFGMAHHGOF-UHFFFAOYSA-N
XLogP3.54
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.52
LogP ≤ 53.54
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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Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine?
The IUPAC name of 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine (CID 102169164) is 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine.
What is the SMILES notation for 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine?
The canonical SMILES for 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine is Fc1ccc(-c2ccnc(I)c2Cl)cn1.
What is the InChIKey of 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine?
The InChIKey is DZRYHFGMAHHGOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5ClFIN2/c11-9-7(3-4-14-10(9)13)6-1-2-8(12)15-5-6/h1-5H.
What are the key properties of 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine?
3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine has a molecular weight of 334.52 g/mol, XLogP of 3.54, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-(6-fluoro-3-pyridinyl)-2-iodopyridine is sourced from PubChem (CID 102169164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).