2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide

C11H12FNO2 — CID 174850108

IUPAC2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide
SMILESCC(=O)Cc1ccc(F)cc1CC(N)=O
InChIInChI=1S/C11H12FNO2/c1-7(14)4-8-2-3-10(12)5-9(8)6-11(13)15/h2-3,5H,4,6H2,1H3,(H2,13,15)
InChIKeyXMCKVYFYCOPVFZ-UHFFFAOYSA-N
MW209.22 g/mol
LogP0.99
Rot. Bonds4

About 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide

2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide (PubChem CID 174850108) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide
PubChem CID174850108
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC Name2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide
SMILESCC(=O)Cc1ccc(F)cc1CC(N)=O
InChIInChI=1S/C11H12FNO2/c1-7(14)4-8-2-3-10(12)5-9(8)6-11(13)15/h2-3,5H,4,6H2,1H3,(H2,13,15)
InChIKeyXMCKVYFYCOPVFZ-UHFFFAOYSA-N
XLogP0.99
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,5-difluorophenyl)acetamide
CID 21245498
2-[2-(2-oxopropyl)phenyl]acetamide
CID 174561343
1-(5-fluoro-2-iodophenyl)propan-2-one
CID 118852730
1-[4-fluoro-2-(trifluoromethyl)phenyl]propan-2-one
CID 117115013
2-[4-fluoro-2-(2-fluorophenyl)phenyl]acetamide
CID 46212372
1-[2-(difluoromethoxy)-5-fluorophenyl]propan-2-one
CID 118813115
2-[4-fluoro-2-(fluoromethyl)phenyl]acetic acid
CID 141066600
[2-(aminomethyl)-4-fluorophenyl] acetate
CID 151844429
4-(2,4-difluorophenyl)butan-2-one
CID 62197971
2-(aminomethyl)-5-fluorobenzamide;hydrochloride
CID 173145989
2-[[2-(aminomethyl)-4-fluorophenyl]methyl-(2-amino-2-oxoethyl)amino]acetamide
CID 63289211
2-[5-fluoro-2-(iodomethyl)phenyl]acetic acid
CID 91883853

Frequently Asked Questions

What is the IUPAC name of 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide?
The IUPAC name of 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide (CID 174850108) is 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide.
What is the SMILES notation for 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide?
The canonical SMILES for 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide is CC(=O)Cc1ccc(F)cc1CC(N)=O.
What is the InChIKey of 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide?
The InChIKey is XMCKVYFYCOPVFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO2/c1-7(14)4-8-2-3-10(12)5-9(8)6-11(13)15/h2-3,5H,4,6H2,1H3,(H2,13,15).
What are the key properties of 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide?
2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide has a molecular weight of 209.22 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-fluoro-2-(2-oxopropyl)phenyl]acetamide is sourced from PubChem (CID 174850108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).