2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide

C16H15FN2O3 — CID 18100358

IUPAC2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide
SMILESCc1ccc(F)cc1NC(=O)COc1ccccc1C(N)=O
InChIInChI=1S/C16H15FN2O3/c1-10-6-7-11(17)8-13(10)19-15(20)9-22-14-5-3-2-4-12(14)16(18)21/h2-8H,9H2,1H3,(H2,18,21)(H,19,20)
InChIKeySHJOILDKYZEYEZ-UHFFFAOYSA-N
MW302.31 g/mol
LogP2.25
Rot. Bonds5

About 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide

2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide (PubChem CID 18100358) has the molecular formula C16H15FN2O3 and a molecular weight of 302.31 g/mol. Its IUPAC name is 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide
PubChem CID18100358
Molecular FormulaC16H15FN2O3
Molecular Weight302.31 g/mol
Exact Mass302.11
IUPAC Name2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide
SMILESCc1ccc(F)cc1NC(=O)COc1ccccc1C(N)=O
InChIInChI=1S/C16H15FN2O3/c1-10-6-7-11(17)8-13(10)19-15(20)9-22-14-5-3-2-4-12(14)16(18)21/h2-8H,9H2,1H3,(H2,18,21)(H,19,20)
InChIKeySHJOILDKYZEYEZ-UHFFFAOYSA-N
XLogP2.25
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.31
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-acetamidophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 2472167
2-(2,5-dimethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 35728477
2-[2-(4-fluoroanilino)-2-oxoethoxy]benzamide
CID 7283884
2-[[2-(2-methylphenoxy)acetyl]amino]benzamide
CID 4268113
2-(2-acetylphenoxy)-N-(2,5-difluorophenyl)acetamide
CID 7859193
2-(2-amino-4-fluorophenoxy)-N-(2-methylphenyl)acetamide
CID 62368683
methyl 2-[2-(2,5-difluoroanilino)-2-oxoethoxy]benzoate
CID 7763972
2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide
CID 3481891
N-(2-amino-4-fluorophenyl)-2-(2-methylphenoxy)acetamide
CID 16792862
2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide
CID 7278808
2-[2-(aminomethyl)-4-fluorophenoxy]-N-(2-methylphenyl)acetamide
CID 107694923
ethyl 2-[2-(2-chloro-4-fluoroanilino)-2-oxoethoxy]benzoate
CID 7694748

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide (CID 18100358) is 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide is Cc1ccc(F)cc1NC(=O)COc1ccccc1C(N)=O.
What is the InChIKey of 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide?
The InChIKey is SHJOILDKYZEYEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O3/c1-10-6-7-11(17)8-13(10)19-15(20)9-22-14-5-3-2-4-12(14)16(18)21/h2-8H,9H2,1H3,(H2,18,21)(H,19,20).
What are the key properties of 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide?
2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide has a molecular weight of 302.31 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide is sourced from PubChem (CID 18100358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).