1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone

C12H11NO3 — CID 28782316

IUPAC1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone
SMILESCC(=O)c1ccccc1OCc1ccno1
InChIInChI=1S/C12H11NO3/c1-9(14)11-4-2-3-5-12(11)15-8-10-6-7-13-16-10/h2-7H,8H2,1H3
InChIKeyULFQOYNEGUCSAO-UHFFFAOYSA-N
MW217.22 g/mol
LogP2.46
Rot. Bonds4

About 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone

1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone (PubChem CID 28782316) has the molecular formula C12H11NO3 and a molecular weight of 217.22 g/mol. Its IUPAC name is 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone.

Molecular Properties

Compound Name1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone
PubChem CID28782316
Molecular FormulaC12H11NO3
Molecular Weight217.22 g/mol
Exact Mass217.07
IUPAC Name1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone
SMILESCC(=O)c1ccccc1OCc1ccno1
InChIInChI=1S/C12H11NO3/c1-9(14)11-4-2-3-5-12(11)15-8-10-6-7-13-16-10/h2-7H,8H2,1H3
InChIKeyULFQOYNEGUCSAO-UHFFFAOYSA-N
XLogP2.46
TPSA52.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.22
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-bromo-2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone
CID 103804028
1-[2-[[2-[(2-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone
CID 13256788
2-methyl-3-(1,2-oxazol-5-ylmethoxy)phenol
CID 43143231
5-[(2-acetylphenoxy)methyl]furan-2-carboxylic acid
CID 4683142
1-[2-[[2-(1,2,2-trifluoroethyl)pyrazol-3-yl]methoxy]phenyl]ethanone
CID 175386633
1-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethanone
CID 28782324
1-[2-[[2-(2,2,2-trifluoroethyl)pyrazol-3-yl]methoxy]phenyl]ethanone
CID 138664353
(1R)-1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]propan-1-amine
CID 55190081
sodium 2-(2-acetylphenoxy)acetate
CID 23600043
1-[2-[(4-chlorophenyl)methoxy]phenyl]ethanone
CID 2763955
N-(1,2-oxazol-5-ylmethyl)-2-propan-2-yloxybenzamide
CID 122135765
1-[2-[(6-methyl-2-pyridinyl)methoxy]phenyl]ethanone
CID 79267970

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone?
The IUPAC name of 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone (CID 28782316) is 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone.
What is the SMILES notation for 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone?
The canonical SMILES for 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone is CC(=O)c1ccccc1OCc1ccno1.
What is the InChIKey of 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone?
The InChIKey is ULFQOYNEGUCSAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO3/c1-9(14)11-4-2-3-5-12(11)15-8-10-6-7-13-16-10/h2-7H,8H2,1H3.
What are the key properties of 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone?
1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone has a molecular weight of 217.22 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone is sourced from PubChem (CID 28782316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).