2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone

C8H8FNO2 — CID 82597856

IUPAC2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone
SMILESNCC(=O)c1ccc(F)cc1O
InChIInChI=1S/C8H8FNO2/c9-5-1-2-6(7(11)3-5)8(12)4-10/h1-3,11H,4,10H2
InChIKeyUZKIWHFJVWNNBR-UHFFFAOYSA-N
MW169.16 g/mol
LogP0.67
Rot. Bonds2

About 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone

2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone (PubChem CID 82597856) has the molecular formula C8H8FNO2 and a molecular weight of 169.16 g/mol. Its IUPAC name is 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone.

Molecular Properties

Compound Name2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone
PubChem CID82597856
Molecular FormulaC8H8FNO2
Molecular Weight169.16 g/mol
Exact Mass169.05
IUPAC Name2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone
SMILESNCC(=O)c1ccc(F)cc1O
InChIInChI=1S/C8H8FNO2/c9-5-1-2-6(7(11)3-5)8(12)4-10/h1-3,11H,4,10H2
InChIKeyUZKIWHFJVWNNBR-UHFFFAOYSA-N
XLogP0.67
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.16
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone?
The IUPAC name of 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone (CID 82597856) is 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone.
What is the SMILES notation for 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone?
The canonical SMILES for 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone is NCC(=O)c1ccc(F)cc1O.
What is the InChIKey of 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone?
The InChIKey is UZKIWHFJVWNNBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO2/c9-5-1-2-6(7(11)3-5)8(12)4-10/h1-3,11H,4,10H2.
What are the key properties of 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone?
2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone has a molecular weight of 169.16 g/mol, XLogP of 0.67, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-fluoro-2-hydroxyphenyl)ethanone is sourced from PubChem (CID 82597856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).