2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid

C10H11FN2O2 — CID 46318079

IUPAC2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid
SMILESO=C(O)c1cc(F)nc(N2CCCC2)c1
InChIInChI=1S/C10H11FN2O2/c11-8-5-7(10(14)15)6-9(12-8)13-3-1-2-4-13/h5-6H,1-4H2,(H,14,15)
InChIKeyVWAYZTJRTOUOEB-UHFFFAOYSA-N
MW210.21 g/mol
LogP1.52
Rot. Bonds2

About 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid

2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid (PubChem CID 46318079) has the molecular formula C10H11FN2O2 and a molecular weight of 210.21 g/mol. Its IUPAC name is 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid
PubChem CID46318079
Molecular FormulaC10H11FN2O2
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Name2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid
SMILESO=C(O)c1cc(F)nc(N2CCCC2)c1
InChIInChI=1S/C10H11FN2O2/c11-8-5-7(10(14)15)6-9(12-8)13-3-1-2-4-13/h5-6H,1-4H2,(H,14,15)
InChIKeyVWAYZTJRTOUOEB-UHFFFAOYSA-N
XLogP1.52
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid 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-6-pyrrolidin-1-ylpyridine-4-carboxylic acid?
The IUPAC name of 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid (CID 46318079) is 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid.
What is the SMILES notation for 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid?
The canonical SMILES for 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid is O=C(O)c1cc(F)nc(N2CCCC2)c1.
What is the InChIKey of 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid?
The InChIKey is VWAYZTJRTOUOEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O2/c11-8-5-7(10(14)15)6-9(12-8)13-3-1-2-4-13/h5-6H,1-4H2,(H,14,15).
What are the key properties of 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid?
2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid has a molecular weight of 210.21 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-pyrrolidin-1-ylpyridine-4-carboxylic acid is sourced from PubChem (CID 46318079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).