2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride

C9H12ClFN2 — CID 171196297

IUPAC2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride
SMILESCl.Fc1ncccc1[C@@H]1CCCN1
InChIInChI=1S/C9H11FN2.ClH/c10-9-7(3-1-6-12-9)8-4-2-5-11-8;/h1,3,6,8,11H,2,4-5H2;1H/t8-;/m0./s1
InChIKeyXNZPHAYKNZOEQX-QRPNPIFTSA-N
MW202.66 g/mol
LogP2.07
Rot. Bonds1

About 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride

2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride (PubChem CID 171196297) has the molecular formula C9H12ClFN2 and a molecular weight of 202.66 g/mol. Its IUPAC name is 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride.

Molecular Properties

Compound Name2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride
PubChem CID171196297
Molecular FormulaC9H12ClFN2
Molecular Weight202.66 g/mol
Exact Mass202.07
IUPAC Name2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride
SMILESCl.Fc1ncccc1[C@@H]1CCCN1
InChIInChI=1S/C9H11FN2.ClH/c10-9-7(3-1-6-12-9)8-4-2-5-11-8;/h1,3,6,8,11H,2,4-5H2;1H/t8-;/m0./s1
InChIKeyXNZPHAYKNZOEQX-QRPNPIFTSA-N
XLogP2.07
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.66
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride with MolForge

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

Launch Full Analysis

Related Compounds

3-[(2S)-azetidin-2-yl]-2-fluoropyridine
CID 55278495
3-[(2S)-aziridin-2-yl]-2-fluoropyridine
CID 55263159
2-chloro-3-[(2S)-pyrrolidin-2-yl]pyridine
CID 55278492
8-[(2S)-pyrrolidin-2-yl]quinoline;dihydrochloride
CID 154574794
(2R)-2-(2-fluoro-3-pyridinyl)piperazine
CID 131149861
2-bromo-3-[(2R)-piperidin-2-yl]pyridine;hydrochloride
CID 171195423
(2S)-2-(2-fluorophenyl)pyrrolidine;hydrochloride
CID 66518510
5-[(2R)-pyrrolidin-2-yl]quinoline
CID 66518640
2-[2-[(2S)-pyrrolidin-2-yl]phenyl]pyridine;hydrochloride
CID 164551354
(2R)-2-(2-fluorophenyl)pyrrolidine;methane
CID 161076171
(4S)-4-(2-fluoro-3-pyridinyl)imidazolidin-2-one
CID 130916233
2-[(2R)-pyrrolidin-2-yl]pyridine
CID 7141590

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride?
The IUPAC name of 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride (CID 171196297) is 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride.
What is the SMILES notation for 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride?
The canonical SMILES for 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride is Cl.Fc1ncccc1[C@@H]1CCCN1.
What is the InChIKey of 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride?
The InChIKey is XNZPHAYKNZOEQX-QRPNPIFTSA-N. The full InChI is InChI=1S/C9H11FN2.ClH/c10-9-7(3-1-6-12-9)8-4-2-5-11-8;/h1,3,6,8,11H,2,4-5H2;1H/t8-;/m0./s1.
What are the key properties of 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride?
2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride has a molecular weight of 202.66 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-[(2S)-pyrrolidin-2-yl]pyridine;hydrochloride is sourced from PubChem (CID 171196297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).