[3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol

C16H24FNO — CID 106529884

IUPAC[3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol
SMILESCCC1(CC)CCN(c2cc(F)cc(CO)c2)CC1
InChIInChI=1S/C16H24FNO/c1-3-16(4-2)5-7-18(8-6-16)15-10-13(12-19)9-14(17)11-15/h9-11,19H,3-8,12H2,1-2H3
InChIKeyOYMBWWKRSUUWEJ-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.72
Rot. Bonds4

About [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol

[3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol (PubChem CID 106529884) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol.

Molecular Properties

Compound Name[3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol
PubChem CID106529884
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name[3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol
SMILESCCC1(CC)CCN(c2cc(F)cc(CO)c2)CC1
InChIInChI=1S/C16H24FNO/c1-3-16(4-2)5-7-18(8-6-16)15-10-13(12-19)9-14(17)11-15/h9-11,19H,3-8,12H2,1-2H3
InChIKeyOYMBWWKRSUUWEJ-UHFFFAOYSA-N
XLogP3.72
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol?
The IUPAC name of [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol (CID 106529884) is [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol.
What is the SMILES notation for [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol?
The canonical SMILES for [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol is CCC1(CC)CCN(c2cc(F)cc(CO)c2)CC1.
What is the InChIKey of [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol?
The InChIKey is OYMBWWKRSUUWEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-3-16(4-2)5-7-18(8-6-16)15-10-13(12-19)9-14(17)11-15/h9-11,19H,3-8,12H2,1-2H3.
What are the key properties of [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol?
[3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol has a molecular weight of 265.37 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4,4-diethylpiperidin-1-yl)-5-fluorophenyl]methanol is sourced from PubChem (CID 106529884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).