3-fluoro-3-prop-2-enylpiperidin-4-ol

C8H14FNO — CID 170563806

IUPAC3-fluoro-3-prop-2-enylpiperidin-4-ol
SMILESC=CCC1(F)CNCCC1O
InChIInChI=1S/C8H14FNO/c1-2-4-8(9)6-10-5-3-7(8)11/h2,7,10-11H,1,3-6H2
InChIKeyRXIIHCDEXOCKMR-UHFFFAOYSA-N
MW159.20 g/mol
LogP0.62
Rot. Bonds2

About 3-fluoro-3-prop-2-enylpiperidin-4-ol

3-fluoro-3-prop-2-enylpiperidin-4-ol (PubChem CID 170563806) has the molecular formula C8H14FNO and a molecular weight of 159.20 g/mol. Its IUPAC name is 3-fluoro-3-prop-2-enylpiperidin-4-ol.

Molecular Properties

Compound Name3-fluoro-3-prop-2-enylpiperidin-4-ol
PubChem CID170563806
Molecular FormulaC8H14FNO
Molecular Weight159.20 g/mol
Exact Mass159.11
IUPAC Name3-fluoro-3-prop-2-enylpiperidin-4-ol
SMILESC=CCC1(F)CNCCC1O
InChIInChI=1S/C8H14FNO/c1-2-4-8(9)6-10-5-3-7(8)11/h2,7,10-11H,1,3-6H2
InChIKeyRXIIHCDEXOCKMR-UHFFFAOYSA-N
XLogP0.62
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.20
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-fluoro-3-prop-2-enylpiperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-3-prop-2-enylpiperidin-4-ol?
The IUPAC name of 3-fluoro-3-prop-2-enylpiperidin-4-ol (CID 170563806) is 3-fluoro-3-prop-2-enylpiperidin-4-ol.
What is the SMILES notation for 3-fluoro-3-prop-2-enylpiperidin-4-ol?
The canonical SMILES for 3-fluoro-3-prop-2-enylpiperidin-4-ol is C=CCC1(F)CNCCC1O.
What is the InChIKey of 3-fluoro-3-prop-2-enylpiperidin-4-ol?
The InChIKey is RXIIHCDEXOCKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FNO/c1-2-4-8(9)6-10-5-3-7(8)11/h2,7,10-11H,1,3-6H2.
What are the key properties of 3-fluoro-3-prop-2-enylpiperidin-4-ol?
3-fluoro-3-prop-2-enylpiperidin-4-ol has a molecular weight of 159.20 g/mol, XLogP of 0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-prop-2-enylpiperidin-4-ol is sourced from PubChem (CID 170563806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).