3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide

C12H12N2O4 — CID 68516644

IUPAC3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide
SMILESCOc1ccc(COc2cc(C(N)=O)on2)cc1
InChIInChI=1S/C12H12N2O4/c1-16-9-4-2-8(3-5-9)7-17-11-6-10(12(13)15)18-14-11/h2-6H,7H2,1H3,(H2,13,15)
InChIKeyUEWOARCRAJKFKB-UHFFFAOYSA-N
MW248.24 g/mol
LogP1.36
Rot. Bonds5

About 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide

3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide (PubChem CID 68516644) has the molecular formula C12H12N2O4 and a molecular weight of 248.24 g/mol. Its IUPAC name is 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide
PubChem CID68516644
Molecular FormulaC12H12N2O4
Molecular Weight248.24 g/mol
Exact Mass248.08
IUPAC Name3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide
SMILESCOc1ccc(COc2cc(C(N)=O)on2)cc1
InChIInChI=1S/C12H12N2O4/c1-16-9-4-2-8(3-5-9)7-17-11-6-10(12(13)15)18-14-11/h2-6H,7H2,1H3,(H2,13,15)
InChIKeyUEWOARCRAJKFKB-UHFFFAOYSA-N
XLogP1.36
TPSA87.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.24
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(4-methoxyphenyl)methoxy]-5-(2H-tetrazol-5-yl)-1,2-oxazole
CID 68558066
3-[(4-methoxyphenyl)methoxy]-N-(1,3-oxazol-2-ylmethyl)-1,2-oxazole-5-carbothioamide
CID 178143927
methyl 3-[(4-cyanophenyl)methoxy]-1,2-oxazole-5-carboxylate
CID 21471720
ethane;methyl 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboximidothioate;oxolane
CID 178143985
methyl 3-[(4-methoxyphenyl)methoxy]-N-(4-methyloxolan-3-yl)-1,2-oxazole-5-carboximidothioate
CID 178144090
4-amino-3-[(4-methoxyphenyl)methoxy]benzamide
CID 63356500
3-(2,5-dimethoxyphenyl)-1,2-oxazole-5-carboxamide
CID 776499
3-methoxy-N-(4-methoxyphenyl)-1,2-oxazole-5-carboxamide
CID 90573837
methyl N-(4,4-dimethyloxolan-3-yl)-3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboximidothioate;propane
CID 178143881
[6-[(4-methoxyphenyl)methoxy]pyridazin-3-yl]methanol
CID 61257374
3-methoxy-5-[(4-methoxyphenyl)methoxy]-4-phenylmethoxybenzamide
CID 126484008
6-[(4-methoxyphenyl)methoxy]pyridine-2,3-diamine
CID 59437374

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide (CID 68516644) is 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide is COc1ccc(COc2cc(C(N)=O)on2)cc1.
What is the InChIKey of 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide?
The InChIKey is UEWOARCRAJKFKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O4/c1-16-9-4-2-8(3-5-9)7-17-11-6-10(12(13)15)18-14-11/h2-6H,7H2,1H3,(H2,13,15).
What are the key properties of 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide?
3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide has a molecular weight of 248.24 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methoxyphenyl)methoxy]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 68516644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).