4-[(2-ethylphenoxy)methyl]-1,2-oxazole

C12H13NO2 — CID 61223505

IUPAC4-[(2-ethylphenoxy)methyl]-1,2-oxazole
SMILESCCc1ccccc1OCc1cnoc1
InChIInChI=1S/C12H13NO2/c1-2-11-5-3-4-6-12(11)14-8-10-7-13-15-9-10/h3-7,9H,2,8H2,1H3
InChIKeyIZPPZXIGPLFHFA-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.82
Rot. Bonds4

About 4-[(2-ethylphenoxy)methyl]-1,2-oxazole

4-[(2-ethylphenoxy)methyl]-1,2-oxazole (PubChem CID 61223505) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is 4-[(2-ethylphenoxy)methyl]-1,2-oxazole.

Molecular Properties

Compound Name4-[(2-ethylphenoxy)methyl]-1,2-oxazole
PubChem CID61223505
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name4-[(2-ethylphenoxy)methyl]-1,2-oxazole
SMILESCCc1ccccc1OCc1cnoc1
InChIInChI=1S/C12H13NO2/c1-2-11-5-3-4-6-12(11)14-8-10-7-13-15-9-10/h3-7,9H,2,8H2,1H3
InChIKeyIZPPZXIGPLFHFA-UHFFFAOYSA-N
XLogP2.82
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-bromophenoxy)methyl]-1,2-oxazole
CID 60871511
1-ethyl-2-[(4-ethylphenyl)methoxy]benzene
CID 64764755
2-[3-methoxy-2-(1,2-oxazol-4-ylmethoxy)phenyl]ethanamine
CID 54930681
1-tert-butyl-4-[(2-ethylphenoxy)methyl]benzene
CID 60627116
[5-methoxy-2-(1,2-oxazol-4-ylmethoxy)phenyl]methanol
CID 60869596
4-[(4-fluorophenoxy)methyl]-1,2-oxazole
CID 61227729
1,2-oxazol-4-ylmethyl 2-(2-aminophenoxy)acetate
CID 61323491
[2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol
CID 82190907
5-[(2-ethylphenoxy)methyl]pyrazin-2-amine
CID 103058694
5-[(2-ethylphenoxy)methyl]-3-methyl-1,2,4-oxadiazole
CID 60718341
3-[(2-ethylphenoxy)methyl]-4-methyl-1,2,5-oxadiazole
CID 64765671
4-(1,2-oxazol-4-ylmethoxy)-1-phenylpyrazole-3-carboxylic acid
CID 60870347

Frequently Asked Questions

What is the IUPAC name of 4-[(2-ethylphenoxy)methyl]-1,2-oxazole?
The IUPAC name of 4-[(2-ethylphenoxy)methyl]-1,2-oxazole (CID 61223505) is 4-[(2-ethylphenoxy)methyl]-1,2-oxazole.
What is the SMILES notation for 4-[(2-ethylphenoxy)methyl]-1,2-oxazole?
The canonical SMILES for 4-[(2-ethylphenoxy)methyl]-1,2-oxazole is CCc1ccccc1OCc1cnoc1.
What is the InChIKey of 4-[(2-ethylphenoxy)methyl]-1,2-oxazole?
The InChIKey is IZPPZXIGPLFHFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c1-2-11-5-3-4-6-12(11)14-8-10-7-13-15-9-10/h3-7,9H,2,8H2,1H3.
What are the key properties of 4-[(2-ethylphenoxy)methyl]-1,2-oxazole?
4-[(2-ethylphenoxy)methyl]-1,2-oxazole has a molecular weight of 203.24 g/mol, XLogP of 2.82, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-ethylphenoxy)methyl]-1,2-oxazole is sourced from PubChem (CID 61223505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).