N-acetyl-2,6-difluorobenzamide

C9H7F2NO2 — CID 2805165

IUPACN-acetyl-2,6-difluorobenzamide
SMILESCC(=O)NC(=O)c1c(F)cccc1F
InChIInChI=1S/C9H7F2NO2/c1-5(13)12-9(14)8-6(10)3-2-4-7(8)11/h2-4H,1H3,(H,12,13,14)
InChIKeyLIXDDHGGXIUMLG-UHFFFAOYSA-N
MW199.16 g/mol
LogP1.24
Rot. Bonds1

About N-acetyl-2,6-difluorobenzamide

N-acetyl-2,6-difluorobenzamide (PubChem CID 2805165) has the molecular formula C9H7F2NO2 and a molecular weight of 199.16 g/mol. Its IUPAC name is N-acetyl-2,6-difluorobenzamide.

Molecular Properties

Compound NameN-acetyl-2,6-difluorobenzamide
PubChem CID2805165
Molecular FormulaC9H7F2NO2
Molecular Weight199.16 g/mol
Exact Mass199.04
IUPAC NameN-acetyl-2,6-difluorobenzamide
SMILESCC(=O)NC(=O)c1c(F)cccc1F
InChIInChI=1S/C9H7F2NO2/c1-5(13)12-9(14)8-6(10)3-2-4-7(8)11/h2-4H,1H3,(H,12,13,14)
InChIKeyLIXDDHGGXIUMLG-UHFFFAOYSA-N
XLogP1.24
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.16
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,6-difluorobenzoyl)carbamic acid;hydrochloride
CID 70544596
N-acetyl-2,3,4,5,6-pentafluorobenzamide
CID 154547448
1-(2,6-difluorophenyl)butane-1,3-dione
CID 43089596
N-(2-aminopropyl)-2,6-difluorobenzamide
CID 63732942
2-acetamido-6-fluorobenzoate
CID 6933649
[(1R)-1-[(2,6-difluorobenzoyl)amino]ethyl]-trihydroxyboranuide
CID 53301829
2,6-difluoro-N-(4-methylphenyl)benzamide;ethane
CID 143234800
[(1R)-1-[(2,6-difluorobenzoyl)amino]ethyl]boronic acid
CID 53324253
N-[2-(dimethylamino)ethyl]-2,6-difluorobenzamide
CID 17249262
2-tert-butyl-6-fluoro-N-methylbenzamide
CID 71273490
1-(2,6-difluorophenyl)-3-methylbut-3-en-1-one
CID 79522478
N-(5-chloro-2-hydroxybenzoyl)-2,6-difluorobenzamide
CID 10244966

Frequently Asked Questions

What is the IUPAC name of N-acetyl-2,6-difluorobenzamide?
The IUPAC name of N-acetyl-2,6-difluorobenzamide (CID 2805165) is N-acetyl-2,6-difluorobenzamide.
What is the SMILES notation for N-acetyl-2,6-difluorobenzamide?
The canonical SMILES for N-acetyl-2,6-difluorobenzamide is CC(=O)NC(=O)c1c(F)cccc1F.
What is the InChIKey of N-acetyl-2,6-difluorobenzamide?
The InChIKey is LIXDDHGGXIUMLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F2NO2/c1-5(13)12-9(14)8-6(10)3-2-4-7(8)11/h2-4H,1H3,(H,12,13,14).
What are the key properties of N-acetyl-2,6-difluorobenzamide?
N-acetyl-2,6-difluorobenzamide has a molecular weight of 199.16 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-2,6-difluorobenzamide is sourced from PubChem (CID 2805165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).