1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone

C16H14N2O3 — CID 71978689

IUPAC1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone
SMILESCC(=O)c1ccc2cc(OCc3nnc(C)o3)ccc2c1
InChIInChI=1S/C16H14N2O3/c1-10(19)12-3-4-14-8-15(6-5-13(14)7-12)20-9-16-18-17-11(2)21-16/h3-8H,9H2,1-2H3
InChIKeyFYMFQKMINSPPHP-UHFFFAOYSA-N
MW282.30 g/mol
LogP3.31
Rot. Bonds4

About 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone

1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone (PubChem CID 71978689) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone.

Molecular Properties

Compound Name1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone
PubChem CID71978689
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Name1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone
SMILESCC(=O)c1ccc2cc(OCc3nnc(C)o3)ccc2c1
InChIInChI=1S/C16H14N2O3/c1-10(19)12-3-4-14-8-15(6-5-13(14)7-12)20-9-16-18-17-11(2)21-16/h3-8H,9H2,1-2H3
InChIKeyFYMFQKMINSPPHP-UHFFFAOYSA-N
XLogP3.31
TPSA65.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]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-[3-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethanone
CID 28782376
(4-fluorophenyl)-[4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]methanone
CID 9109074
1-[4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]propan-2-one
CID 115495260
1-[6-(1,2-oxazol-5-ylmethoxy)naphthalen-2-yl]ethanone
CID 71863244
2-[(4-ethoxyphenoxy)methyl]-5-methyl-1,3,4-oxadiazole
CID 110655535
3-[5-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]-2-pyridinyl]prop-2-enoic acid
CID 79800146
1-[2-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethanone
CID 28782324
(1S)-1-[2-fluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethanol
CID 107720562
2-methyl-5-[(4-propan-2-ylphenoxy)methyl]-1,3,4-oxadiazole
CID 60627683
4-methyl-2-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzoic acid
CID 60651733
1-[3-chloro-4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethanone
CID 113389828
2-methyl-5-[[6-(trifluoromethoxy)quinolin-2-yl]oxymethyl]-1,3,4-oxadiazole
CID 167796668

Frequently Asked Questions

What is the IUPAC name of 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone?
The IUPAC name of 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone (CID 71978689) is 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone.
What is the SMILES notation for 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone?
The canonical SMILES for 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone is CC(=O)c1ccc2cc(OCc3nnc(C)o3)ccc2c1.
What is the InChIKey of 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone?
The InChIKey is FYMFQKMINSPPHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-10(19)12-3-4-14-8-15(6-5-13(14)7-12)20-9-16-18-17-11(2)21-16/h3-8H,9H2,1-2H3.
What are the key properties of 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone?
1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone has a molecular weight of 282.30 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]naphthalen-2-yl]ethanone is sourced from PubChem (CID 71978689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).