2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide

C15H13F3N2O — CID 79044745

IUPAC2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide
SMILESCc1cc(F)cc(NC(C(N)=O)c2cccc(F)c2F)c1
InChIInChI=1S/C15H13F3N2O/c1-8-5-9(16)7-10(6-8)20-14(15(19)21)11-3-2-4-12(17)13(11)18/h2-7,14,20H,1H3,(H2,19,21)
InChIKeyFCSIWXACYZJXOR-UHFFFAOYSA-N
MW294.28 g/mol
LogP3.05
Rot. Bonds4

About 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide

2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide (PubChem CID 79044745) has the molecular formula C15H13F3N2O and a molecular weight of 294.28 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide
PubChem CID79044745
Molecular FormulaC15H13F3N2O
Molecular Weight294.28 g/mol
Exact Mass294.10
IUPAC Name2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide
SMILESCc1cc(F)cc(NC(C(N)=O)c2cccc(F)c2F)c1
InChIInChI=1S/C15H13F3N2O/c1-8-5-9(16)7-10(6-8)20-14(15(19)21)11-3-2-4-12(17)13(11)18/h2-7,14,20H,1H3,(H2,19,21)
InChIKeyFCSIWXACYZJXOR-UHFFFAOYSA-N
XLogP3.05
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.28
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-fluoro-5-methylanilino)-2-(2-methoxyphenyl)acetamide
CID 79044484
2-(3-chloroanilino)-2-(2,3-difluorophenyl)acetamide
CID 63667747
2-(2-bromo-5-chlorophenyl)-2-(3-fluoro-5-methylanilino)acetamide
CID 79041273
2-(3-fluoro-5-methylanilino)-2-(3-hydroxyphenyl)acetamide
CID 79055466
2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)ethanol
CID 79049466
2-(4-bromo-3-fluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide
CID 81431305
2-(2,5-difluorophenyl)-2-(3-methylanilino)acetamide
CID 61005085
2-(1,5-dimethylpyrazol-4-yl)-2-(3-fluoro-5-methylanilino)acetamide
CID 79583974
2-(3-fluoro-5-methylanilino)-2-pyridin-3-ylacetamide
CID 79055306
2-(2,3-difluorophenyl)-2-(propylamino)acetamide
CID 63668774
2-(3-fluoroanilino)-2-(2,4,6-trimethylphenyl)acetamide
CID 60996177
2-(5-bromo-2-fluorophenyl)-2-(3-methylanilino)acetamide
CID 61005182

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide?
The IUPAC name of 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide (CID 79044745) is 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide.
What is the SMILES notation for 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide?
The canonical SMILES for 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide is Cc1cc(F)cc(NC(C(N)=O)c2cccc(F)c2F)c1.
What is the InChIKey of 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide?
The InChIKey is FCSIWXACYZJXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O/c1-8-5-9(16)7-10(6-8)20-14(15(19)21)11-3-2-4-12(17)13(11)18/h2-7,14,20H,1H3,(H2,19,21).
What are the key properties of 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide?
2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide has a molecular weight of 294.28 g/mol, XLogP of 3.05, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-2-(3-fluoro-5-methylanilino)acetamide is sourced from PubChem (CID 79044745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).