(4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol

C11H15FN2O — CID 90100109

IUPAC(4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol
SMILESOC(c1ccc(F)cc1)C1CNCCN1
InChIInChI=1S/C11H15FN2O/c12-9-3-1-8(2-4-9)11(15)10-7-13-5-6-14-10/h1-4,10-11,13-15H,5-7H2
InChIKeyDFTJOHHVBSJJGW-UHFFFAOYSA-N
MW210.25 g/mol
LogP0.42
Rot. Bonds2

About (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol

(4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol (PubChem CID 90100109) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol.

Molecular Properties

Compound Name(4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol
PubChem CID90100109
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name(4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol
SMILESOC(c1ccc(F)cc1)C1CNCCN1
InChIInChI=1S/C11H15FN2O/c12-9-3-1-8(2-4-9)11(15)10-7-13-5-6-14-10/h1-4,10-11,13-15H,5-7H2
InChIKeyDFTJOHHVBSJJGW-UHFFFAOYSA-N
XLogP0.42
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol?
The IUPAC name of (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol (CID 90100109) is (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol.
What is the SMILES notation for (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol?
The canonical SMILES for (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol is OC(c1ccc(F)cc1)C1CNCCN1.
What is the InChIKey of (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol?
The InChIKey is DFTJOHHVBSJJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c12-9-3-1-8(2-4-9)11(15)10-7-13-5-6-14-10/h1-4,10-11,13-15H,5-7H2.
What are the key properties of (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol?
(4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol has a molecular weight of 210.25 g/mol, XLogP of 0.42, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[(2R)-piperazin-2-yl]methanol is sourced from PubChem (CID 90100109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).