1-(3-fluoropiperidin-4-yl)ethanol

C7H14FNO — CID 178035000

IUPAC1-(3-fluoropiperidin-4-yl)ethanol
SMILESCC(O)C1CCNCC1F
InChIInChI=1S/C7H14FNO/c1-5(10)6-2-3-9-4-7(6)8/h5-7,9-10H,2-4H2,1H3
InChIKeyGINYYXVLDRFJMV-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.31
Rot. Bonds1

About 1-(3-fluoropiperidin-4-yl)ethanol

1-(3-fluoropiperidin-4-yl)ethanol (PubChem CID 178035000) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is 1-(3-fluoropiperidin-4-yl)ethanol.

Molecular Properties

Compound Name1-(3-fluoropiperidin-4-yl)ethanol
PubChem CID178035000
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name1-(3-fluoropiperidin-4-yl)ethanol
SMILESCC(O)C1CCNCC1F
InChIInChI=1S/C7H14FNO/c1-5(10)6-2-3-9-4-7(6)8/h5-7,9-10H,2-4H2,1H3
InChIKeyGINYYXVLDRFJMV-UHFFFAOYSA-N
XLogP0.31
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropiperidin-4-yl)ethanol?
The IUPAC name of 1-(3-fluoropiperidin-4-yl)ethanol (CID 178035000) is 1-(3-fluoropiperidin-4-yl)ethanol.
What is the SMILES notation for 1-(3-fluoropiperidin-4-yl)ethanol?
The canonical SMILES for 1-(3-fluoropiperidin-4-yl)ethanol is CC(O)C1CCNCC1F.
What is the InChIKey of 1-(3-fluoropiperidin-4-yl)ethanol?
The InChIKey is GINYYXVLDRFJMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c1-5(10)6-2-3-9-4-7(6)8/h5-7,9-10H,2-4H2,1H3.
What are the key properties of 1-(3-fluoropiperidin-4-yl)ethanol?
1-(3-fluoropiperidin-4-yl)ethanol has a molecular weight of 147.19 g/mol, XLogP of 0.31, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropiperidin-4-yl)ethanol is sourced from PubChem (CID 178035000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).