1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol

C14H20FNO2 — CID 110892142

IUPAC1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol
SMILESOCC1CCCCN1CC(O)c1ccccc1F
InChIInChI=1S/C14H20FNO2/c15-13-7-2-1-6-12(13)14(18)9-16-8-4-3-5-11(16)10-17/h1-2,6-7,11,14,17-18H,3-5,8-10H2
InChIKeyHODZFCDDBSJBTD-UHFFFAOYSA-N
MW253.32 g/mol
LogP1.71
Rot. Bonds4

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

1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol (PubChem CID 110892142) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol
PubChem CID110892142
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC Name1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol
SMILESOCC1CCCCN1CC(O)c1ccccc1F
InChIInChI=1S/C14H20FNO2/c15-13-7-2-1-6-12(13)14(18)9-16-8-4-3-5-11(16)10-17/h1-2,6-7,11,14,17-18H,3-5,8-10H2
InChIKeyHODZFCDDBSJBTD-UHFFFAOYSA-N
XLogP1.71
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(2-bromophenyl)-2-[(2R)-2-(hydroxymethyl)piperidin-1-yl]ethanol
CID 97326124
(1R)-1-(2-fluorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]ethanol
CID 95153941
(1R)-1-(2-fluorophenyl)-2-[(2S)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]ethanol
CID 129448916
1-[(2-fluorophenyl)methoxy]-3-[2-(hydroxymethyl)piperidin-1-yl]propan-2-ol
CID 110877558
(1R)-1-(3,4-difluorophenyl)-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]ethanol
CID 95334420
1-(4-aminophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol
CID 62265580
[1-[(2,6-difluorophenyl)methyl]azepan-2-yl]methanol
CID 114933196
1-(2-fluorophenyl)-2-(3-pyrrolidin-1-ylpiperidin-1-yl)ethanol
CID 110898564
(1S)-1-(2-fluorophenyl)-2-[4-[(2S)-2-(2-fluorophenyl)-2-hydroxyethyl]piperazin-1-yl]ethanol
CID 34179618
2-(aziridin-1-yl)-1-(2-fluorophenyl)ethanol
CID 82125307
1-(2-fluorophenyl)-3-[2-(3-hydroxypropyl)pyrrolidin-1-yl]propan-1-ol
CID 62631035
1-(2-fluorophenyl)-2-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]ethanol
CID 110899499

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol?
The IUPAC name of 1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol (CID 110892142) is 1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol.
What is the SMILES notation for 1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol?
The canonical SMILES for 1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol is OCC1CCCCN1CC(O)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol?
The InChIKey is HODZFCDDBSJBTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2/c15-13-7-2-1-6-12(13)14(18)9-16-8-4-3-5-11(16)10-17/h1-2,6-7,11,14,17-18H,3-5,8-10H2.
What are the key properties of 1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol?
1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol has a molecular weight of 253.32 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-2-[2-(hydroxymethyl)piperidin-1-yl]ethanol is sourced from PubChem (CID 110892142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).