1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone

C16H13NO3 — CID 71863244

IUPAC1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone
SMILESCC(=O)c1ccc2cc(OCc3ccno3)ccc2c1
InChIInChI=1S/C16H13NO3/c1-11(18)12-2-3-14-9-15(5-4-13(14)8-12)19-10-16-6-7-17-20-16/h2-9H,10H2,1H3
InChIKeySYUWMRFLGGGHLU-UHFFFAOYSA-N
MW267.28 g/mol
LogP3.61
Rot. Bonds4

About 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone

1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone (PubChem CID 71863244) has the molecular formula C16H13NO3 and a molecular weight of 267.28 g/mol. Its IUPAC name is 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone.

Molecular Properties

Compound Name1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone
PubChem CID71863244
Molecular FormulaC16H13NO3
Molecular Weight267.28 g/mol
Exact Mass267.09
IUPAC Name1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone
SMILESCC(=O)c1ccc2cc(OCc3ccno3)ccc2c1
InChIInChI=1S/C16H13NO3/c1-11(18)12-2-3-14-9-15(5-4-13(14)8-12)19-10-16-6-7-17-20-16/h2-9H,10H2,1H3
InChIKeySYUWMRFLGGGHLU-UHFFFAOYSA-N
XLogP3.61
TPSA52.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]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-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone
CID 71978689
1-[4-bromo-2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone
CID 103804028
1-[2-(1,2-oxazol-5-ylmethoxy)phenyl]ethanone
CID 28782316
4-methoxy-N-(1,2-oxazol-5-ylmethoxy)benzamide
CID 91285519
1-[4-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxy]phenyl]ethanone
CID 66156413
1-[3-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]ethanone
CID 28782365
1-(7-acetylanthracen-2-yl)ethanone
CID 139364083
1-[4-methoxy-3-(naphthalen-2-yloxymethyl)phenyl]ethanone
CID 7919546
[4-(methylamino)phenyl] 4-[(6-acetylnaphthalen-2-yl)oxymethyl]benzoate
CID 20591302
(1R)-1-[4-(1,2-oxazol-5-ylmethoxy)phenyl]propan-1-amine
CID 78937022
1-[3-[[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1,2-oxazol-5-yl]methoxy]phenyl]ethanone
CID 75471143
methyl 5-[(4-acetylphenoxy)methyl]-2-methylfuran-3-carboxylate
CID 78767749

Frequently Asked Questions

What is the IUPAC name of 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone?
The IUPAC name of 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone (CID 71863244) is 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone.
What is the SMILES notation for 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone?
The canonical SMILES for 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone is CC(=O)c1ccc2cc(OCc3ccno3)ccc2c1.
What is the InChIKey of 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone?
The InChIKey is SYUWMRFLGGGHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO3/c1-11(18)12-2-3-14-9-15(5-4-13(14)8-12)19-10-16-6-7-17-20-16/h2-9H,10H2,1H3.
What are the key properties of 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone?
1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone has a molecular weight of 267.28 g/mol, XLogP of 3.61, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone is sourced from PubChem (CID 71863244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).