N-(3,4-difluoro-2-methylphenyl)acetamide

C9H9F2NO — CID 15692403

IUPACN-(3,4-difluoro-2-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(F)c(F)c1C
InChIInChI=1S/C9H9F2NO/c1-5-8(12-6(2)13)4-3-7(10)9(5)11/h3-4H,1-2H3,(H,12,13)
InChIKeyJHDZKZJWLLMVGL-UHFFFAOYSA-N
MW185.17 g/mol
LogP2.23
Rot. Bonds1

About N-(3,4-difluoro-2-methylphenyl)acetamide

N-(3,4-difluoro-2-methylphenyl)acetamide (PubChem CID 15692403) has the molecular formula C9H9F2NO and a molecular weight of 185.17 g/mol. Its IUPAC name is N-(3,4-difluoro-2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(3,4-difluoro-2-methylphenyl)acetamide
PubChem CID15692403
Molecular FormulaC9H9F2NO
Molecular Weight185.17 g/mol
Exact Mass185.07
IUPAC NameN-(3,4-difluoro-2-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(F)c(F)c1C
InChIInChI=1S/C9H9F2NO/c1-5-8(12-6(2)13)4-3-7(10)9(5)11/h3-4H,1-2H3,(H,12,13)
InChIKeyJHDZKZJWLLMVGL-UHFFFAOYSA-N
XLogP2.23
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.17
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 101479656
N-(2-fluoro-4-iodo-3-methylphenyl)acetamide
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N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide
CID 67281170
N-(4-chloro-2-fluorophenyl)acetamide;hydrochloride
CID 142696618
N-(2-fluoro-4-isocyano-3-methylphenyl)acetamide
CID 88856199
N-(4-acetamido-2,5-difluorophenyl)acetamide
CID 176892585
4-chloro-N-(3,4-difluoro-2-methylphenyl)-3-hydroxysulfanylbenzamide
CID 145366859
N-(3-chloro-4-fluoro-2-methylphenyl)propanamide
CID 159195412
ethane;N-(2-fluoro-3-methylphenyl)acetamide
CID 145070564
N-(3,4-dibromo-2-methylphenyl)acetamide
CID 131862600
1-(3-chloro-2-methylphenyl)-3-(2,3,4-trifluorophenyl)urea
CID 108892437
N-(3,4-difluoro-5-methoxy-2-methylphenyl)acetamide;ethane
CID 178095697

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluoro-2-methylphenyl)acetamide?
The IUPAC name of N-(3,4-difluoro-2-methylphenyl)acetamide (CID 15692403) is N-(3,4-difluoro-2-methylphenyl)acetamide.
What is the SMILES notation for N-(3,4-difluoro-2-methylphenyl)acetamide?
The canonical SMILES for N-(3,4-difluoro-2-methylphenyl)acetamide is CC(=O)Nc1ccc(F)c(F)c1C.
What is the InChIKey of N-(3,4-difluoro-2-methylphenyl)acetamide?
The InChIKey is JHDZKZJWLLMVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F2NO/c1-5-8(12-6(2)13)4-3-7(10)9(5)11/h3-4H,1-2H3,(H,12,13).
What are the key properties of N-(3,4-difluoro-2-methylphenyl)acetamide?
N-(3,4-difluoro-2-methylphenyl)acetamide has a molecular weight of 185.17 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluoro-2-methylphenyl)acetamide is sourced from PubChem (CID 15692403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).