N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide

C17H13F2N3O3 — CID 43972286

IUPACN-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1nnc(-c2ccc(F)cc2F)o1
InChIInChI=1S/C17H13F2N3O3/c1-10-4-2-3-5-14(10)24-9-15(23)20-17-22-21-16(25-17)12-7-6-11(18)8-13(12)19/h2-8H,9H2,1H3,(H,20,22,23)
InChIKeyBXVLTUVRZFAMHN-UHFFFAOYSA-N
MW345.31 g/mol
LogP3.34
Rot. Bonds5

About N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide

N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide (PubChem CID 43972286) has the molecular formula C17H13F2N3O3 and a molecular weight of 345.31 g/mol. Its IUPAC name is N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide
PubChem CID43972286
Molecular FormulaC17H13F2N3O3
Molecular Weight345.31 g/mol
Exact Mass345.09
IUPAC NameN-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)Nc1nnc(-c2ccc(F)cc2F)o1
InChIInChI=1S/C17H13F2N3O3/c1-10-4-2-3-5-14(10)24-9-15(23)20-17-22-21-16(25-17)12-7-6-11(18)8-13(12)19/h2-8H,9H2,1H3,(H,20,22,23)
InChIKeyBXVLTUVRZFAMHN-UHFFFAOYSA-N
XLogP3.34
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.31
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methoxyphenoxy)acetamide
CID 43972062
2-(4-chlorophenoxy)-N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]acetamide
CID 43972110
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(4-fluorophenyl)acetamide
CID 43972042
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-3-phenylpropanamide
CID 43972157
N-(2-amino-4-fluorophenyl)-2-(2-methylphenoxy)acetamide
CID 16792862
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 43972074
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-4-methylbenzamide
CID 43972075
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-3-methoxynaphthalene-2-carboxamide
CID 43972172
[2-(2,4-difluoroanilino)-2-oxoethyl] 2-(2-methylphenoxy)acetate
CID 2555443
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2,2-diphenylacetamide
CID 43972132
[2-oxo-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)amino]ethyl] 2-(2-fluorophenoxy)acetate
CID 9140177
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]furan-2-carboxamide
CID 43972032

Frequently Asked Questions

What is the IUPAC name of N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide (CID 43972286) is N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)Nc1nnc(-c2ccc(F)cc2F)o1.
What is the InChIKey of N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide?
The InChIKey is BXVLTUVRZFAMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F2N3O3/c1-10-4-2-3-5-14(10)24-9-15(23)20-17-22-21-16(25-17)12-7-6-11(18)8-13(12)19/h2-8H,9H2,1H3,(H,20,22,23).
What are the key properties of N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide?
N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide has a molecular weight of 345.31 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2,4-difluorophenyl)-1,3,4-oxadiazol-2-yl]-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 43972286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).