2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide

C10H9N3O3 — CID 7556131

IUPAC2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESNC(=O)COc1ccc(-c2nnco2)cc1
InChIInChI=1S/C10H9N3O3/c11-9(14)5-15-8-3-1-7(2-4-8)10-13-12-6-16-10/h1-4,6H,5H2,(H2,11,14)
InChIKeyMKDZLHLWMDKNOW-UHFFFAOYSA-N
MW219.20 g/mol
LogP0.60
Rot. Bonds4

About 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide

2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide (PubChem CID 7556131) has the molecular formula C10H9N3O3 and a molecular weight of 219.20 g/mol. Its IUPAC name is 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
PubChem CID7556131
Molecular FormulaC10H9N3O3
Molecular Weight219.20 g/mol
Exact Mass219.06
IUPAC Name2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESNC(=O)COc1ccc(-c2nnco2)cc1
InChIInChI=1S/C10H9N3O3/c11-9(14)5-15-8-3-1-7(2-4-8)10-13-12-6-16-10/h1-4,6H,5H2,(H2,11,14)
InChIKeyMKDZLHLWMDKNOW-UHFFFAOYSA-N
XLogP0.60
TPSA91.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 8001302
2-[4-(2-methylprop-2-enoxy)phenyl]-1,3,4-oxadiazole
CID 71944586
2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]-1-(2,4,5-trimethylphenyl)ethanone
CID 4826899
N-(3,5-difluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 42368891
2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]-N-(2,4,4-trimethylpentan-2-yl)acetamide
CID 8888706
1-(3-bromophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone
CID 8569592
ethyl 2,5-dimethyl-4-[2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetyl]-1H-pyrrole-3-carboxylate
CID 7555934
1-(1,3-benzodioxol-5-yl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone
CID 8528159
N-(4-acetylphenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 7556222
1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone
CID 7556262
N-[(4-chlorophenyl)methyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 7556147
N-[(4-ethylphenyl)methyl]-N-methyl-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 8888415

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The IUPAC name of 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide (CID 7556131) is 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide.
What is the SMILES notation for 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The canonical SMILES for 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide is NC(=O)COc1ccc(-c2nnco2)cc1.
What is the InChIKey of 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The InChIKey is MKDZLHLWMDKNOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O3/c11-9(14)5-15-8-3-1-7(2-4-8)10-13-12-6-16-10/h1-4,6H,5H2,(H2,11,14).
What are the key properties of 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide has a molecular weight of 219.20 g/mol, XLogP of 0.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide is sourced from PubChem (CID 7556131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).