2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide

C16H13FN2O4 — CID 110662188

IUPAC2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide
SMILESCn1c(=O)oc2cc(NC(=O)COc3ccccc3F)ccc21
InChIInChI=1S/C16H13FN2O4/c1-19-12-7-6-10(8-14(12)23-16(19)21)18-15(20)9-22-13-5-3-2-4-11(13)17/h2-8H,9H2,1H3,(H,18,20)
InChIKeyUILFSVAOOFWPOH-UHFFFAOYSA-N
MW316.29 g/mol
LogP2.29
Rot. Bonds4

About 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide

2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide (PubChem CID 110662188) has the molecular formula C16H13FN2O4 and a molecular weight of 316.29 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide
PubChem CID110662188
Molecular FormulaC16H13FN2O4
Molecular Weight316.29 g/mol
Exact Mass316.09
IUPAC Name2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide
SMILESCn1c(=O)oc2cc(NC(=O)COc3ccccc3F)ccc21
InChIInChI=1S/C16H13FN2O4/c1-19-12-7-6-10(8-14(12)23-16(19)21)18-15(20)9-22-13-5-3-2-4-11(13)17/h2-8H,9H2,1H3,(H,18,20)
InChIKeyUILFSVAOOFWPOH-UHFFFAOYSA-N
XLogP2.29
TPSA73.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.29
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethoxy-3-fluorophenyl)-2-(2-fluorophenoxy)acetamide
CID 110777396
2-(2-fluorophenoxy)-N-(1-methyl-2-oxo-3H-indol-5-yl)acetamide
CID 18570797
2-(3-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)acetamide
CID 110662032
4-methyl-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-4-phenylpentanamide
CID 110608238
5-(4-fluorophenyl)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)pentanamide
CID 110616444
3-(2-fluorophenyl)-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)propanamide
CID 110607968
N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-5-oxo-5-phenylpentanamide
CID 110412208
N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-2-(4-methylphenyl)acetamide
CID 110662181
N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-methoxyphenoxy)acetamide
CID 6458101
N-(3-amino-4-chlorophenyl)-2-(2-fluorophenoxy)acetamide
CID 16793498
2-(2-fluorophenoxy)-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 7491916
3-[[2-(2-fluorophenoxy)acetyl]amino]benzamide
CID 51152953

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide (CID 110662188) is 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide is Cn1c(=O)oc2cc(NC(=O)COc3ccccc3F)ccc21.
What is the InChIKey of 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide?
The InChIKey is UILFSVAOOFWPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O4/c1-19-12-7-6-10(8-14(12)23-16(19)21)18-15(20)9-22-13-5-3-2-4-11(13)17/h2-8H,9H2,1H3,(H,18,20).
What are the key properties of 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide?
2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide has a molecular weight of 316.29 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)acetamide is sourced from PubChem (CID 110662188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).