1-(5-fluoropyrimidin-2-yl)ethanol

C6H7FN2O — CID 66570653

IUPAC1-(5-fluoropyrimidin-2-yl)ethanol
SMILESCC(O)c1ncc(F)cn1
InChIInChI=1S/C6H7FN2O/c1-4(10)6-8-2-5(7)3-9-6/h2-4,10H,1H3
InChIKeyQYBNANBJFUDNAI-UHFFFAOYSA-N
MW142.13 g/mol
LogP0.67
Rot. Bonds1

About 1-(5-fluoropyrimidin-2-yl)ethanol

1-(5-fluoropyrimidin-2-yl)ethanol (PubChem CID 66570653) has the molecular formula C6H7FN2O and a molecular weight of 142.13 g/mol. Its IUPAC name is 1-(5-fluoropyrimidin-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-fluoropyrimidin-2-yl)ethanol
PubChem CID66570653
Molecular FormulaC6H7FN2O
Molecular Weight142.13 g/mol
Exact Mass142.05
IUPAC Name1-(5-fluoropyrimidin-2-yl)ethanol
SMILESCC(O)c1ncc(F)cn1
InChIInChI=1S/C6H7FN2O/c1-4(10)6-8-2-5(7)3-9-6/h2-4,10H,1H3
InChIKeyQYBNANBJFUDNAI-UHFFFAOYSA-N
XLogP0.67
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.13
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoropyrimidin-2-yl)ethanol?
The IUPAC name of 1-(5-fluoropyrimidin-2-yl)ethanol (CID 66570653) is 1-(5-fluoropyrimidin-2-yl)ethanol.
What is the SMILES notation for 1-(5-fluoropyrimidin-2-yl)ethanol?
The canonical SMILES for 1-(5-fluoropyrimidin-2-yl)ethanol is CC(O)c1ncc(F)cn1.
What is the InChIKey of 1-(5-fluoropyrimidin-2-yl)ethanol?
The InChIKey is QYBNANBJFUDNAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2O/c1-4(10)6-8-2-5(7)3-9-6/h2-4,10H,1H3.
What are the key properties of 1-(5-fluoropyrimidin-2-yl)ethanol?
1-(5-fluoropyrimidin-2-yl)ethanol has a molecular weight of 142.13 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoropyrimidin-2-yl)ethanol is sourced from PubChem (CID 66570653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).