3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride

C9H12ClFN2O — CID 86276895

IUPAC3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride
SMILESCl.Fc1cccnc1OC1CCNC1
InChIInChI=1S/C9H11FN2O.ClH/c10-8-2-1-4-12-9(8)13-7-3-5-11-6-7;/h1-2,4,7,11H,3,5-6H2;1H
InChIKeyKNUIRKBSHMWQLY-UHFFFAOYSA-N
MW218.66 g/mol
LogP1.38
Rot. Bonds2

About 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride

3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride (PubChem CID 86276895) has the molecular formula C9H12ClFN2O and a molecular weight of 218.66 g/mol. Its IUPAC name is 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride.

Molecular Properties

Compound Name3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride
PubChem CID86276895
Molecular FormulaC9H12ClFN2O
Molecular Weight218.66 g/mol
Exact Mass218.06
IUPAC Name3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride
SMILESCl.Fc1cccnc1OC1CCNC1
InChIInChI=1S/C9H11FN2O.ClH/c10-8-2-1-4-12-9(8)13-7-3-5-11-6-7;/h1-2,4,7,11H,3,5-6H2;1H
InChIKeyKNUIRKBSHMWQLY-UHFFFAOYSA-N
XLogP1.38
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.66
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride?
The IUPAC name of 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride (CID 86276895) is 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride.
What is the SMILES notation for 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride?
The canonical SMILES for 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride is Cl.Fc1cccnc1OC1CCNC1.
What is the InChIKey of 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride?
The InChIKey is KNUIRKBSHMWQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2O.ClH/c10-8-2-1-4-12-9(8)13-7-3-5-11-6-7;/h1-2,4,7,11H,3,5-6H2;1H.
What are the key properties of 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride?
3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride has a molecular weight of 218.66 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-pyrrolidin-3-yloxypyridine;hydrochloride is sourced from PubChem (CID 86276895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).