1-fluoropyrrolidin-2-ol

C4H8FNO — CID 174911437

IUPAC1-fluoropyrrolidin-2-ol
SMILESOC1CCCN1F
InChIInChI=1S/C4H8FNO/c5-6-3-1-2-4(6)7/h4,7H,1-3H2
InChIKeyFGZLEBLFXRJHEJ-UHFFFAOYSA-N
MW105.11 g/mol
LogP0.29
Rot. Bonds

About 1-fluoropyrrolidin-2-ol

1-fluoropyrrolidin-2-ol (PubChem CID 174911437) has the molecular formula C4H8FNO and a molecular weight of 105.11 g/mol. Its IUPAC name is 1-fluoropyrrolidin-2-ol.

Molecular Properties

Compound Name1-fluoropyrrolidin-2-ol
PubChem CID174911437
Molecular FormulaC4H8FNO
Molecular Weight105.11 g/mol
Exact Mass105.06
IUPAC Name1-fluoropyrrolidin-2-ol
SMILESOC1CCCN1F
InChIInChI=1S/C4H8FNO/c5-6-3-1-2-4(6)7/h4,7H,1-3H2
InChIKeyFGZLEBLFXRJHEJ-UHFFFAOYSA-N
XLogP0.29
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.11
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-fluoropyrrolidin-2-ol?
The IUPAC name of 1-fluoropyrrolidin-2-ol (CID 174911437) is 1-fluoropyrrolidin-2-ol.
What is the SMILES notation for 1-fluoropyrrolidin-2-ol?
The canonical SMILES for 1-fluoropyrrolidin-2-ol is OC1CCCN1F.
What is the InChIKey of 1-fluoropyrrolidin-2-ol?
The InChIKey is FGZLEBLFXRJHEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNO/c5-6-3-1-2-4(6)7/h4,7H,1-3H2.
What are the key properties of 1-fluoropyrrolidin-2-ol?
1-fluoropyrrolidin-2-ol has a molecular weight of 105.11 g/mol, XLogP of 0.29, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoropyrrolidin-2-ol is sourced from PubChem (CID 174911437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).