[(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol

C12H16FNO2 — CID 66961888

IUPAC[(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol
SMILESOC[C@H]1C[C@H](Oc2ccc(F)cc2)CCN1
InChIInChI=1S/C12H16FNO2/c13-9-1-3-11(4-2-9)16-12-5-6-14-10(7-12)8-15/h1-4,10,12,14-15H,5-8H2/t10-,12-/m1/s1
InChIKeyUNIJFBAIYJWXDU-ZYHUDNBSSA-N
MW225.26 g/mol
LogP1.32
Rot. Bonds3

About [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol

[(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol (PubChem CID 66961888) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol
PubChem CID66961888
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC Name[(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol
SMILESOC[C@H]1C[C@H](Oc2ccc(F)cc2)CCN1
InChIInChI=1S/C12H16FNO2/c13-9-1-3-11(4-2-9)16-12-5-6-14-10(7-12)8-15/h1-4,10,12,14-15H,5-8H2/t10-,12-/m1/s1
InChIKeyUNIJFBAIYJWXDU-ZYHUDNBSSA-N
XLogP1.32
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol?
The IUPAC name of [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol (CID 66961888) is [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol.
What is the SMILES notation for [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol?
The canonical SMILES for [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol is OC[C@H]1C[C@H](Oc2ccc(F)cc2)CCN1.
What is the InChIKey of [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol?
The InChIKey is UNIJFBAIYJWXDU-ZYHUDNBSSA-N. The full InChI is InChI=1S/C12H16FNO2/c13-9-1-3-11(4-2-9)16-12-5-6-14-10(7-12)8-15/h1-4,10,12,14-15H,5-8H2/t10-,12-/m1/s1.
What are the key properties of [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol?
[(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol has a molecular weight of 225.26 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,4R)-4-(4-fluorophenoxy)piperidin-2-yl]methanol is sourced from PubChem (CID 66961888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).