[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol

C14H20FNO — CID 22733849

IUPAC[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol
SMILESOCC1CCN(CCc2ccc(F)cc2)CC1
InChIInChI=1S/C14H20FNO/c15-14-3-1-12(2-4-14)5-8-16-9-6-13(11-17)7-10-16/h1-4,13,17H,5-11H2
InChIKeyDLQBUPQXNGGRLR-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.07
Rot. Bonds4

About [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol

[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol (PubChem CID 22733849) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol
PubChem CID22733849
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol
SMILESOCC1CCN(CCc2ccc(F)cc2)CC1
InChIInChI=1S/C14H20FNO/c15-14-3-1-12(2-4-14)5-8-16-9-6-13(11-17)7-10-16/h1-4,13,17H,5-11H2
InChIKeyDLQBUPQXNGGRLR-UHFFFAOYSA-N
XLogP2.07
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol?
The IUPAC name of [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol (CID 22733849) is [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol.
What is the SMILES notation for [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol?
The canonical SMILES for [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol is OCC1CCN(CCc2ccc(F)cc2)CC1.
What is the InChIKey of [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol?
The InChIKey is DLQBUPQXNGGRLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c15-14-3-1-12(2-4-14)5-8-16-9-6-13(11-17)7-10-16/h1-4,13,17H,5-11H2.
What are the key properties of [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol?
[1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol has a molecular weight of 237.32 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl]methanol is sourced from PubChem (CID 22733849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).