1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol

C14H20FNO — CID 111106746

IUPAC1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol
SMILESCC(O)C1CCCCN1Cc1ccc(F)cc1
InChIInChI=1S/C14H20FNO/c1-11(17)14-4-2-3-9-16(14)10-12-5-7-13(15)8-6-12/h5-8,11,14,17H,2-4,9-10H2,1H3
InChIKeyPIOOICKNHKHACT-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.56
Rot. Bonds3

About 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol

1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol (PubChem CID 111106746) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol
PubChem CID111106746
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol
SMILESCC(O)C1CCCCN1Cc1ccc(F)cc1
InChIInChI=1S/C14H20FNO/c1-11(17)14-4-2-3-9-16(14)10-12-5-7-13(15)8-6-12/h5-8,11,14,17H,2-4,9-10H2,1H3
InChIKeyPIOOICKNHKHACT-UHFFFAOYSA-N
XLogP2.56
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]benzamide
CID 111106900
(1R)-1-[(2S)-1-[(4-aminophenyl)methyl]pyrrolidin-2-yl]ethanol
CID 129390025
1-[1-[(4-aminophenyl)methyl]pyrrolidin-2-yl]ethanol
CID 59300179
1-[1-(1H-pyrrol-3-ylmethyl)piperidin-2-yl]ethanol
CID 115882687
(1R)-1-[(2R)-1-[(4-nitrophenyl)methyl]piperidin-2-yl]ethanol
CID 95353429
1-[1-(furan-3-ylmethyl)piperidin-2-yl]ethanol
CID 115882688
1-[1-[3-(4-fluorophenyl)prop-2-enyl]piperidin-2-yl]ethanol
CID 91941500
(1R)-1-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-2-yl]ethanol
CID 95354319
1-[1-[[2-(4-fluorophenyl)-1,3-oxazol-4-yl]methyl]piperidin-2-yl]ethanol
CID 111106797
2,4,6-tris[[2-(1-hydroxyethyl)piperidin-1-yl]methyl]phenol
CID 141293787
4-[[2-(1-aminoethyl)piperidin-1-yl]methyl]phenol
CID 63254190
(1S)-1-[(2R)-1-[(3-methoxyphenyl)methyl]piperidin-2-yl]ethanol
CID 95342192

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol?
The IUPAC name of 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol (CID 111106746) is 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol?
The canonical SMILES for 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol is CC(O)C1CCCCN1Cc1ccc(F)cc1.
What is the InChIKey of 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol?
The InChIKey is PIOOICKNHKHACT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-11(17)14-4-2-3-9-16(14)10-12-5-7-13(15)8-6-12/h5-8,11,14,17H,2-4,9-10H2,1H3.
What are the key properties of 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol?
1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol has a molecular weight of 237.32 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(4-fluorophenyl)methyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 111106746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).