(3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol

C9H17FN2O — CID 171547295

IUPAC(3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol
SMILESOCC1(F)CN(C2CCNCC2)C1
InChIInChI=1S/C9H17FN2O/c10-9(7-13)5-12(6-9)8-1-3-11-4-2-8/h8,11,13H,1-7H2
InChIKeyXVOFPUBDEFHQDF-UHFFFAOYSA-N
MW188.25 g/mol
LogP-0.25
Rot. Bonds2

About (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol

(3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol (PubChem CID 171547295) has the molecular formula C9H17FN2O and a molecular weight of 188.25 g/mol. Its IUPAC name is (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol.

Molecular Properties

Compound Name(3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol
PubChem CID171547295
Molecular FormulaC9H17FN2O
Molecular Weight188.25 g/mol
Exact Mass188.13
IUPAC Name(3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol
SMILESOCC1(F)CN(C2CCNCC2)C1
InChIInChI=1S/C9H17FN2O/c10-9(7-13)5-12(6-9)8-1-3-11-4-2-8/h8,11,13H,1-7H2
InChIKeyXVOFPUBDEFHQDF-UHFFFAOYSA-N
XLogP-0.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.25
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol 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-1-piperidin-4-ylazetidin-3-yl)methanol?
The IUPAC name of (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol (CID 171547295) is (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol.
What is the SMILES notation for (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol?
The canonical SMILES for (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol is OCC1(F)CN(C2CCNCC2)C1.
What is the InChIKey of (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol?
The InChIKey is XVOFPUBDEFHQDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17FN2O/c10-9(7-13)5-12(6-9)8-1-3-11-4-2-8/h8,11,13H,1-7H2.
What are the key properties of (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol?
(3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol has a molecular weight of 188.25 g/mol, XLogP of -0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-1-piperidin-4-ylazetidin-3-yl)methanol is sourced from PubChem (CID 171547295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).