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

C12H14N2O3 — CID 28783005

IUPAC[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol
SMILESCCc1noc(COc2ccccc2CO)n1
InChIInChI=1S/C12H14N2O3/c1-2-11-13-12(17-14-11)8-16-10-6-4-3-5-9(10)7-15/h3-6,15H,2,7-8H2,1H3
InChIKeyKTIUQOOTKMEOKN-UHFFFAOYSA-N
MW234.25 g/mol
LogP1.70
Rot. Bonds5

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

[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol (PubChem CID 28783005) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol
PubChem CID28783005
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol
SMILESCCc1noc(COc2ccccc2CO)n1
InChIInChI=1S/C12H14N2O3/c1-2-11-13-12(17-14-11)8-16-10-6-4-3-5-9(10)7-15/h3-6,15H,2,7-8H2,1H3
InChIKeyKTIUQOOTKMEOKN-UHFFFAOYSA-N
XLogP1.70
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol with MolForge

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Related Compounds

5-[(2-bromophenoxy)methyl]-3-ethyl-1,2,4-oxadiazole
CID 28782458
N-[[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methyl]-2-methylpropan-1-amine
CID 63058170
N-[[2-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methyl]ethanamine
CID 61495262
5-[(2-ethylphenoxy)methyl]-3-methyl-1,2,4-oxadiazole
CID 60718341
[3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol
CID 28782950
5-ethyl-3-(naphthalen-1-yloxymethyl)-1,2,4-oxadiazole
CID 63862061
3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenol
CID 43143517
5-[(2-fluorophenoxy)methyl]-3-propyl-1,2,4-oxadiazole
CID 60731170
[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methoxy]-4-methoxyphenyl]methanol
CID 61496996
1-[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326409
N-[[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methyl]-2-methylpropan-1-amine
CID 63057157
1-[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 60878906

Frequently Asked Questions

What is the IUPAC name of [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol?
The IUPAC name of [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol (CID 28783005) is [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol.
What is the SMILES notation for [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol?
The canonical SMILES for [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol is CCc1noc(COc2ccccc2CO)n1.
What is the InChIKey of [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol?
The InChIKey is KTIUQOOTKMEOKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c1-2-11-13-12(17-14-11)8-16-10-6-4-3-5-9(10)7-15/h3-6,15H,2,7-8H2,1H3.
What are the key properties of [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol?
[2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol has a molecular weight of 234.25 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]methanol is sourced from PubChem (CID 28783005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).