3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol

C11H12N2O3 — CID 43143517

IUPAC3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol
SMILESCCc1noc(COc2cccc(O)c2)n1
InChIInChI=1S/C11H12N2O3/c1-2-10-12-11(16-13-10)7-15-9-5-3-4-8(14)6-9/h3-6,14H,2,7H2,1H3
InChIKeyPLYQXWPWWSBZKF-UHFFFAOYSA-N
MW220.23 g/mol
LogP1.92
Rot. Bonds4

About 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol

3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol (PubChem CID 43143517) has the molecular formula C11H12N2O3 and a molecular weight of 220.23 g/mol. Its IUPAC name is 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol.

Molecular Properties

Compound Name3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol
PubChem CID43143517
Molecular FormulaC11H12N2O3
Molecular Weight220.23 g/mol
Exact Mass220.08
IUPAC Name3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol
SMILESCCc1noc(COc2cccc(O)c2)n1
InChIInChI=1S/C11H12N2O3/c1-2-10-12-11(16-13-10)7-15-9-5-3-4-8(14)6-9/h3-6,14H,2,7H2,1H3
InChIKeyPLYQXWPWWSBZKF-UHFFFAOYSA-N
XLogP1.92
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(5-ethyl-1,2,4-oxadiazol-3-yl)methoxy]phenol
CID 61497436
[3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol
CID 28782950
(1R)-1-[3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol
CID 55189536
[3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanamine
CID 60879242
5-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]-2,3-dihydro-1H-inden-1-ol
CID 107684835
1-[4-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanone
CID 28782310
N-methyl-1-[3-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanamine
CID 61495346
[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol
CID 28783005
(1R)-1-[4-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]-2-fluorophenyl]ethanamine
CID 107718366
1-[4-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]-2-fluorophenyl]ethanamine
CID 107716111
5-[[3-bromo-4-(trifluoromethoxy)phenoxy]methyl]-3-ethyl-1,2,4-oxadiazole
CID 102674590
3-[(5-ethyl-1,2,4-oxadiazol-3-yl)methoxy]benzaldehyde
CID 54959294

Frequently Asked Questions

What is the IUPAC name of 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol?
The IUPAC name of 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol (CID 43143517) is 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol.
What is the SMILES notation for 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol?
The canonical SMILES for 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol is CCc1noc(COc2cccc(O)c2)n1.
What is the InChIKey of 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol?
The InChIKey is PLYQXWPWWSBZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O3/c1-2-10-12-11(16-13-10)7-15-9-5-3-4-8(14)6-9/h3-6,14H,2,7H2,1H3.
What are the key properties of 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol?
3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol has a molecular weight of 220.23 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol is sourced from PubChem (CID 43143517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).