2-[(3-methoxyphenoxy)methyl]-1,3-oxazole

C11H11NO3 — CID 117186726

IUPAC2-[(3-methoxyphenoxy)methyl]-1,3-oxazole
SMILESCOc1cccc(OCc2ncco2)c1
InChIInChI=1S/C11H11NO3/c1-13-9-3-2-4-10(7-9)15-8-11-12-5-6-14-11/h2-7H,8H2,1H3
InChIKeyIGWOXLAUWSWUKL-UHFFFAOYSA-N
MW205.21 g/mol
LogP2.26
Rot. Bonds4

About 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole

2-[(3-methoxyphenoxy)methyl]-1,3-oxazole (PubChem CID 117186726) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole.

Molecular Properties

Compound Name2-[(3-methoxyphenoxy)methyl]-1,3-oxazole
PubChem CID117186726
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name2-[(3-methoxyphenoxy)methyl]-1,3-oxazole
SMILESCOc1cccc(OCc2ncco2)c1
InChIInChI=1S/C11H11NO3/c1-13-9-3-2-4-10(7-9)15-8-11-12-5-6-14-11/h2-7H,8H2,1H3
InChIKeyIGWOXLAUWSWUKL-UHFFFAOYSA-N
XLogP2.26
TPSA44.49 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(pyridin-3-yloxymethyl)-1,3-oxazole
CID 54003976
2-chloro-5-[(3-methoxyphenoxy)methyl]-1,3-thiazole
CID 79764226
2-[(3-methoxyphenoxy)methyl]-[1,3]oxazolo[4,5-b]pyridin-6-amine
CID 82337490
[2-[(3-methoxyphenoxy)methyl]-1,3-thiazol-5-yl]methanamine
CID 95461249
5-[(3-methoxyphenoxy)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole
CID 3159105
2-[(3-methoxyphenoxy)methyl]-5-methyl-1,3-thiazole
CID 117188251
2-(3,4-dimethoxyphenyl)-5-[(3-methoxyphenoxy)methyl]-1,3,4-oxadiazole
CID 110655896
2-[(3-ethoxyphenoxy)methyl]-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CID 110655825
5-bromo-2-[(3-methoxyphenoxy)methyl]-1,3-thiazole
CID 117188254
(3-methoxyphenoxy)methanol
CID 10442564
1-(chloromethoxy)-3-methoxybenzene
CID 59086252
CID 172849383
CID 172849383

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole?
The IUPAC name of 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole (CID 117186726) is 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole.
What is the SMILES notation for 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole?
The canonical SMILES for 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole is COc1cccc(OCc2ncco2)c1.
What is the InChIKey of 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole?
The InChIKey is IGWOXLAUWSWUKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c1-13-9-3-2-4-10(7-9)15-8-11-12-5-6-14-11/h2-7H,8H2,1H3.
What are the key properties of 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole?
2-[(3-methoxyphenoxy)methyl]-1,3-oxazole has a molecular weight of 205.21 g/mol, XLogP of 2.26, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyphenoxy)methyl]-1,3-oxazole is sourced from PubChem (CID 117186726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).