5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine

C13H13FN2O — CID 119040542

IUPAC5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine
SMILESFc1ccc(N2CCCC2c2ccco2)nc1
InChIInChI=1S/C13H13FN2O/c14-10-5-6-13(15-9-10)16-7-1-3-11(16)12-4-2-8-17-12/h2,4-6,8-9,11H,1,3,7H2
InChIKeyNMZJLTPXIRBWQJ-UHFFFAOYSA-N
MW232.26 g/mol
LogP3.16
Rot. Bonds2

About 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine

5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine (PubChem CID 119040542) has the molecular formula C13H13FN2O and a molecular weight of 232.26 g/mol. Its IUPAC name is 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine.

Molecular Properties

Compound Name5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine
PubChem CID119040542
Molecular FormulaC13H13FN2O
Molecular Weight232.26 g/mol
Exact Mass232.10
IUPAC Name5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine
SMILESFc1ccc(N2CCCC2c2ccco2)nc1
InChIInChI=1S/C13H13FN2O/c14-10-5-6-13(15-9-10)16-7-1-3-11(16)12-4-2-8-17-12/h2,4-6,8-9,11H,1,3,7H2
InChIKeyNMZJLTPXIRBWQJ-UHFFFAOYSA-N
XLogP3.16
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine?
The IUPAC name of 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine (CID 119040542) is 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine.
What is the SMILES notation for 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine?
The canonical SMILES for 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine is Fc1ccc(N2CCCC2c2ccco2)nc1.
What is the InChIKey of 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine?
The InChIKey is NMZJLTPXIRBWQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O/c14-10-5-6-13(15-9-10)16-7-1-3-11(16)12-4-2-8-17-12/h2,4-6,8-9,11H,1,3,7H2.
What are the key properties of 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine?
5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine has a molecular weight of 232.26 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-[2-(furan-2-yl)pyrrolidin-1-yl]pyridine is sourced from PubChem (CID 119040542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).