2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine

C9H10FIN2 — CID 46318097

IUPAC2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine
SMILESFc1nc(N2CCCC2)ccc1I
InChIInChI=1S/C9H10FIN2/c10-9-7(11)3-4-8(12-9)13-5-1-2-6-13/h3-4H,1-2,5-6H2
InChIKeyQGVGKWCABZEKJP-UHFFFAOYSA-N
MW292.09 g/mol
LogP2.43
Rot. Bonds1

About 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine

2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine (PubChem CID 46318097) has the molecular formula C9H10FIN2 and a molecular weight of 292.09 g/mol. Its IUPAC name is 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine.

Molecular Properties

Compound Name2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine
PubChem CID46318097
Molecular FormulaC9H10FIN2
Molecular Weight292.09 g/mol
Exact Mass291.99
IUPAC Name2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine
SMILESFc1nc(N2CCCC2)ccc1I
InChIInChI=1S/C9H10FIN2/c10-9-7(11)3-4-8(12-9)13-5-1-2-6-13/h3-4H,1-2,5-6H2
InChIKeyQGVGKWCABZEKJP-UHFFFAOYSA-N
XLogP2.43
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.09
LogP ≤ 52.43
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'}

Analyze 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine?
The IUPAC name of 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine (CID 46318097) is 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine.
What is the SMILES notation for 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine?
The canonical SMILES for 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine is Fc1nc(N2CCCC2)ccc1I.
What is the InChIKey of 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine?
The InChIKey is QGVGKWCABZEKJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FIN2/c10-9-7(11)3-4-8(12-9)13-5-1-2-6-13/h3-4H,1-2,5-6H2.
What are the key properties of 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine?
2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine has a molecular weight of 292.09 g/mol, XLogP of 2.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-iodo-6-pyrrolidin-1-ylpyridine is sourced from PubChem (CID 46318097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).