1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine

C10H19FN2O — CID 91299424

IUPAC1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine
SMILESON1CCCC(C2CCCCN2F)C1
InChIInChI=1S/C10H19FN2O/c11-13-7-2-1-5-10(13)9-4-3-6-12(14)8-9/h9-10,14H,1-8H2
InChIKeySMPHOKNPWLGBQN-UHFFFAOYSA-N
MW202.27 g/mol
LogP1.83
Rot. Bonds1

About 1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine

1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine (PubChem CID 91299424) has the molecular formula C10H19FN2O and a molecular weight of 202.27 g/mol. Its IUPAC name is 1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine.

Molecular Properties

Compound Name1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine
PubChem CID91299424
Molecular FormulaC10H19FN2O
Molecular Weight202.27 g/mol
Exact Mass202.15
IUPAC Name1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine
SMILESON1CCCC(C2CCCCN2F)C1
InChIInChI=1S/C10H19FN2O/c11-13-7-2-1-5-10(13)9-4-3-6-12(14)8-9/h9-10,14H,1-8H2
InChIKeySMPHOKNPWLGBQN-UHFFFAOYSA-N
XLogP1.83
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.27
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine?
The IUPAC name of 1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine (CID 91299424) is 1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine.
What is the SMILES notation for 1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine?
The canonical SMILES for 1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine is ON1CCCC(C2CCCCN2F)C1.
What is the InChIKey of 1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine?
The InChIKey is SMPHOKNPWLGBQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2O/c11-13-7-2-1-5-10(13)9-4-3-6-12(14)8-9/h9-10,14H,1-8H2.
What are the key properties of 1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine?
1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine has a molecular weight of 202.27 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-(1-hydroxypiperidin-3-yl)piperidine is sourced from PubChem (CID 91299424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).