2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine

C10H13FN2 — CID 10821243

IUPAC2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine
SMILESCN1CCCC1c1ccc(F)nc1
InChIInChI=1S/C10H13FN2/c1-13-6-2-3-9(13)8-4-5-10(11)12-7-8/h4-5,7,9H,2-3,6H2,1H3
InChIKeyKQCRJWUYEISYJL-UHFFFAOYSA-N
MW180.23 g/mol
LogP1.99
Rot. Bonds1

About 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine

2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine (PubChem CID 10821243) has the molecular formula C10H13FN2 and a molecular weight of 180.23 g/mol. Its IUPAC name is 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine.

Molecular Properties

Compound Name2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine
PubChem CID10821243
Molecular FormulaC10H13FN2
Molecular Weight180.23 g/mol
Exact Mass180.11
IUPAC Name2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine
SMILESCN1CCCC1c1ccc(F)nc1
InChIInChI=1S/C10H13FN2/c1-13-6-2-3-9(13)8-4-5-10(11)12-7-8/h4-5,7,9H,2-3,6H2,1H3
InChIKeyKQCRJWUYEISYJL-UHFFFAOYSA-N
XLogP1.99
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine?
The IUPAC name of 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine (CID 10821243) is 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine.
What is the SMILES notation for 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine?
The canonical SMILES for 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine is CN1CCCC1c1ccc(F)nc1.
What is the InChIKey of 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine?
The InChIKey is KQCRJWUYEISYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2/c1-13-6-2-3-9(13)8-4-5-10(11)12-7-8/h4-5,7,9H,2-3,6H2,1H3.
What are the key properties of 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine?
2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine has a molecular weight of 180.23 g/mol, XLogP of 1.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-(1-methylpyrrolidin-2-yl)pyridine is sourced from PubChem (CID 10821243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).