N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide

C12H10F2N2O2 — CID 110428961

IUPACN-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc(F)c(F)c2)no1
InChIInChI=1S/C12H10F2N2O2/c1-7-4-9(16-18-7)6-12(17)15-8-2-3-10(13)11(14)5-8/h2-5H,6H2,1H3,(H,15,17)
InChIKeyQQVSREDIXGZOCH-UHFFFAOYSA-N
MW252.22 g/mol
LogP2.44
Rot. Bonds3

About N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide

N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 110428961) has the molecular formula C12H10F2N2O2 and a molecular weight of 252.22 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID110428961
Molecular FormulaC12H10F2N2O2
Molecular Weight252.22 g/mol
Exact Mass252.07
IUPAC NameN-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc(F)c(F)c2)no1
InChIInChI=1S/C12H10F2N2O2/c1-7-4-9(16-18-7)6-12(17)15-8-2-3-10(13)11(14)5-8/h2-5H,6H2,1H3,(H,15,17)
InChIKeyQQVSREDIXGZOCH-UHFFFAOYSA-N
XLogP2.44
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.22
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 68647812
2-[2-fluoro-4-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]phenoxy]propanoic acid
CID 136556563
N-(4-bromophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110421673
3-(3,4-difluorophenyl)-1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
CID 47194688
2-(5-methyl-1,2-oxazol-3-yl)-N-(3-methylphenyl)acetamide
CID 110417275
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110427091
2-(5-methyl-1,2-oxazol-3-yl)-N-(4-phenoxyphenyl)acetamide
CID 110425586
2-(5-methyl-1,2-oxazol-3-yl)-N-(4-piperidin-1-ylphenyl)acetamide
CID 110424986
methyl 3-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]benzoate
CID 110424177
2-(5-methyl-1,2-oxazol-3-yl)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide
CID 110608265
N-(3-bromo-5-methylphenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110614176
N-(5-fluoro-2-hydroxyphenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 75433797

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 110428961) is N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1cc(CC(=O)Nc2ccc(F)c(F)c2)no1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is QQVSREDIXGZOCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2N2O2/c1-7-4-9(16-18-7)6-12(17)15-8-2-3-10(13)11(14)5-8/h2-5H,6H2,1H3,(H,15,17).
What are the key properties of N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide?
N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 252.22 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 110428961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).