N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide

C10H12FNO2 — CID 68502030

IUPACN-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide
SMILESCC(=O)NCCc1ccc(F)cc1O
InChIInChI=1S/C10H12FNO2/c1-7(13)12-5-4-8-2-3-9(11)6-10(8)14/h2-3,6,14H,4-5H2,1H3,(H,12,13)
InChIKeyGCCFWTNYJHUOJE-UHFFFAOYSA-N
MW197.21 g/mol
LogP1.21
Rot. Bonds3

About N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide

N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide (PubChem CID 68502030) has the molecular formula C10H12FNO2 and a molecular weight of 197.21 g/mol. Its IUPAC name is N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide
PubChem CID68502030
Molecular FormulaC10H12FNO2
Molecular Weight197.21 g/mol
Exact Mass197.09
IUPAC NameN-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide
SMILESCC(=O)NCCc1ccc(F)cc1O
InChIInChI=1S/C10H12FNO2/c1-7(13)12-5-4-8-2-3-9(11)6-10(8)14/h2-3,6,14H,4-5H2,1H3,(H,12,13)
InChIKeyGCCFWTNYJHUOJE-UHFFFAOYSA-N
XLogP1.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide?
The IUPAC name of N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide (CID 68502030) is N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide.
What is the SMILES notation for N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide?
The canonical SMILES for N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide is CC(=O)NCCc1ccc(F)cc1O.
What is the InChIKey of N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide?
The InChIKey is GCCFWTNYJHUOJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2/c1-7(13)12-5-4-8-2-3-9(11)6-10(8)14/h2-3,6,14H,4-5H2,1H3,(H,12,13).
What are the key properties of N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide?
N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide has a molecular weight of 197.21 g/mol, XLogP of 1.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluoro-2-hydroxyphenyl)ethyl]acetamide is sourced from PubChem (CID 68502030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).