3-fluoropiperidine-2,6-diol

C5H10FNO2 — CID 141010456

IUPAC3-fluoropiperidine-2,6-diol
SMILESOC1CCC(F)C(O)N1
InChIInChI=1S/C5H10FNO2/c6-3-1-2-4(8)7-5(3)9/h3-5,7-9H,1-2H2
InChIKeyWXYSVOIRAYKITM-UHFFFAOYSA-N
MW135.14 g/mol
LogP-0.66
Rot. Bonds

About 3-fluoropiperidine-2,6-diol

3-fluoropiperidine-2,6-diol (PubChem CID 141010456) has the molecular formula C5H10FNO2 and a molecular weight of 135.14 g/mol. Its IUPAC name is 3-fluoropiperidine-2,6-diol.

Molecular Properties

Compound Name3-fluoropiperidine-2,6-diol
PubChem CID141010456
Molecular FormulaC5H10FNO2
Molecular Weight135.14 g/mol
Exact Mass135.07
IUPAC Name3-fluoropiperidine-2,6-diol
SMILESOC1CCC(F)C(O)N1
InChIInChI=1S/C5H10FNO2/c6-3-1-2-4(8)7-5(3)9/h3-5,7-9H,1-2H2
InChIKeyWXYSVOIRAYKITM-UHFFFAOYSA-N
XLogP-0.66
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 5-0.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoropiperidine-2,6-diol?
The IUPAC name of 3-fluoropiperidine-2,6-diol (CID 141010456) is 3-fluoropiperidine-2,6-diol.
What is the SMILES notation for 3-fluoropiperidine-2,6-diol?
The canonical SMILES for 3-fluoropiperidine-2,6-diol is OC1CCC(F)C(O)N1.
What is the InChIKey of 3-fluoropiperidine-2,6-diol?
The InChIKey is WXYSVOIRAYKITM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO2/c6-3-1-2-4(8)7-5(3)9/h3-5,7-9H,1-2H2.
What are the key properties of 3-fluoropiperidine-2,6-diol?
3-fluoropiperidine-2,6-diol has a molecular weight of 135.14 g/mol, XLogP of -0.66, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoropiperidine-2,6-diol is sourced from PubChem (CID 141010456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).