(4-fluoro-3-piperazin-1-ylphenyl)methanol

C11H15FN2O — CID 20785507

IUPAC(4-fluoro-3-piperazin-1-ylphenyl)methanol
SMILESOCc1ccc(F)c(N2CCNCC2)c1
InChIInChI=1S/C11H15FN2O/c12-10-2-1-9(8-15)7-11(10)14-5-3-13-4-6-14/h1-2,7,13,15H,3-6,8H2
InChIKeyFGQRHLHRBLTFQI-UHFFFAOYSA-N
MW210.25 g/mol
LogP0.73
Rot. Bonds2

About (4-fluoro-3-piperazin-1-ylphenyl)methanol

(4-fluoro-3-piperazin-1-ylphenyl)methanol (PubChem CID 20785507) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is (4-fluoro-3-piperazin-1-ylphenyl)methanol.

Molecular Properties

Compound Name(4-fluoro-3-piperazin-1-ylphenyl)methanol
PubChem CID20785507
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name(4-fluoro-3-piperazin-1-ylphenyl)methanol
SMILESOCc1ccc(F)c(N2CCNCC2)c1
InChIInChI=1S/C11H15FN2O/c12-10-2-1-9(8-15)7-11(10)14-5-3-13-4-6-14/h1-2,7,13,15H,3-6,8H2
InChIKeyFGQRHLHRBLTFQI-UHFFFAOYSA-N
XLogP0.73
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-piperazin-1-ylphenyl)methanol?
The IUPAC name of (4-fluoro-3-piperazin-1-ylphenyl)methanol (CID 20785507) is (4-fluoro-3-piperazin-1-ylphenyl)methanol.
What is the SMILES notation for (4-fluoro-3-piperazin-1-ylphenyl)methanol?
The canonical SMILES for (4-fluoro-3-piperazin-1-ylphenyl)methanol is OCc1ccc(F)c(N2CCNCC2)c1.
What is the InChIKey of (4-fluoro-3-piperazin-1-ylphenyl)methanol?
The InChIKey is FGQRHLHRBLTFQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c12-10-2-1-9(8-15)7-11(10)14-5-3-13-4-6-14/h1-2,7,13,15H,3-6,8H2.
What are the key properties of (4-fluoro-3-piperazin-1-ylphenyl)methanol?
(4-fluoro-3-piperazin-1-ylphenyl)methanol has a molecular weight of 210.25 g/mol, XLogP of 0.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-3-piperazin-1-ylphenyl)methanol is sourced from PubChem (CID 20785507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).