N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

C15H10F2N2O3 — CID 4139727

IUPACN-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESO=C(Cn1c(=O)oc2ccccc21)Nc1ccc(F)c(F)c1
InChIInChI=1S/C15H10F2N2O3/c16-10-6-5-9(7-11(10)17)18-14(20)8-19-12-3-1-2-4-13(12)22-15(19)21/h1-7H,8H2,(H,18,20)
InChIKeyLPEVWSREMORGMN-UHFFFAOYSA-N
MW304.25 g/mol
LogP2.51
Rot. Bonds3

About N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (PubChem CID 4139727) has the molecular formula C15H10F2N2O3 and a molecular weight of 304.25 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
PubChem CID4139727
Molecular FormulaC15H10F2N2O3
Molecular Weight304.25 g/mol
Exact Mass304.07
IUPAC NameN-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESO=C(Cn1c(=O)oc2ccccc21)Nc1ccc(F)c(F)c1
InChIInChI=1S/C15H10F2N2O3/c16-10-6-5-9(7-11(10)17)18-14(20)8-19-12-3-1-2-4-13(12)22-15(19)21/h1-7H,8H2,(H,18,20)
InChIKeyLPEVWSREMORGMN-UHFFFAOYSA-N
XLogP2.51
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.25
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (CID 4139727) is N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is O=C(Cn1c(=O)oc2ccccc21)Nc1ccc(F)c(F)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The InChIKey is LPEVWSREMORGMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N2O3/c16-10-6-5-9(7-11(10)17)18-14(20)8-19-12-3-1-2-4-13(12)22-15(19)21/h1-7H,8H2,(H,18,20).
What are the key properties of N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide has a molecular weight of 304.25 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is sourced from PubChem (CID 4139727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).