2-fluoro-5-methoxypyrrolidine

C5H10FNO — CID 151882268

IUPAC2-fluoro-5-methoxypyrrolidine
SMILESCOC1CCC(F)N1
InChIInChI=1S/C5H10FNO/c1-8-5-3-2-4(6)7-5/h4-5,7H,2-3H2,1H3
InChIKeySOZACEFIQQUUJG-UHFFFAOYSA-N
MW119.14 g/mol
LogP0.64
Rot. Bonds1

About 2-fluoro-5-methoxypyrrolidine

2-fluoro-5-methoxypyrrolidine (PubChem CID 151882268) has the molecular formula C5H10FNO and a molecular weight of 119.14 g/mol. Its IUPAC name is 2-fluoro-5-methoxypyrrolidine.

Molecular Properties

Compound Name2-fluoro-5-methoxypyrrolidine
PubChem CID151882268
Molecular FormulaC5H10FNO
Molecular Weight119.14 g/mol
Exact Mass119.07
IUPAC Name2-fluoro-5-methoxypyrrolidine
SMILESCOC1CCC(F)N1
InChIInChI=1S/C5H10FNO/c1-8-5-3-2-4(6)7-5/h4-5,7H,2-3H2,1H3
InChIKeySOZACEFIQQUUJG-UHFFFAOYSA-N
XLogP0.64
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.14
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methoxypyrrolidine?
The IUPAC name of 2-fluoro-5-methoxypyrrolidine (CID 151882268) is 2-fluoro-5-methoxypyrrolidine.
What is the SMILES notation for 2-fluoro-5-methoxypyrrolidine?
The canonical SMILES for 2-fluoro-5-methoxypyrrolidine is COC1CCC(F)N1.
What is the InChIKey of 2-fluoro-5-methoxypyrrolidine?
The InChIKey is SOZACEFIQQUUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO/c1-8-5-3-2-4(6)7-5/h4-5,7H,2-3H2,1H3.
What are the key properties of 2-fluoro-5-methoxypyrrolidine?
2-fluoro-5-methoxypyrrolidine has a molecular weight of 119.14 g/mol, XLogP of 0.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-methoxypyrrolidine is sourced from PubChem (CID 151882268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).