3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole

C17H15NO2 — CID 164614812

IUPAC3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole
SMILESCc1cc(-c2ccccc2OCc2ccccc2)on1
InChIInChI=1S/C17H15NO2/c1-13-11-17(20-18-13)15-9-5-6-10-16(15)19-12-14-7-3-2-4-8-14/h2-11H,12H2,1H3
InChIKeyWDAVMBMFBORGAD-UHFFFAOYSA-N
MW265.31 g/mol
LogP4.23
Rot. Bonds4

About 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole

3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole (PubChem CID 164614812) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole.

Molecular Properties

Compound Name3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole
PubChem CID164614812
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Name3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole
SMILESCc1cc(-c2ccccc2OCc2ccccc2)on1
InChIInChI=1S/C17H15NO2/c1-13-11-17(20-18-13)15-9-5-6-10-16(15)19-12-14-7-3-2-4-8-14/h2-11H,12H2,1H3
InChIKeyWDAVMBMFBORGAD-UHFFFAOYSA-N
XLogP4.23
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Isoxazole, 5-(4-methoxyphenyl)-3-phenyl-
CID 279122
Ethanone, 1-(5-(4,5-dihydro-2-oxazolyl)-2-((5-(3-methyl-5-isoxazolyl)pentyl)oxy)phenyl)-
CID 5271232
Methyl 3,5-diphenyl-1,2-oxazole-4-carboxylate
CID 827480
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-~{N}-(3-methoxyphenyl)benzamide
CID 25163346
5-[(4-Fluorophenoxy)methyl]-3-phenyl-1,2-oxazole
CID 1480817
(7-Methyl-2-oxochromen-4-yl)methyl 3,5-dimethyl-1,2-oxazole-4-carboxylate
CID 2539745
2-(3-Phenyl-5-isoxazolyl)phenol
CID 873352
3,4-Bis(4-methoxyphenyl)-5-methylisoxazole
CID 3954928
3-(4-Butoxy-phenyl)-isoxazole
CID 11378954
4-[3-(3-Carbamimidoylphenyl)-1,2-oxazol-5-yl]-3-methoxybenzenecarboximidamide
CID 11990735
4-[3-(4-Carbamimidoyl-2-methoxyphenyl)-1,2-oxazol-5-yl]-3-methoxybenzenecarboximidamide
CID 11990760
4-[3-(4-Carbamimidoylphenyl)-1,2-oxazol-5-yl]-3-methoxybenzenecarboximidamide
CID 11990763

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole?
The IUPAC name of 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole (CID 164614812) is 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole.
What is the SMILES notation for 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole?
The canonical SMILES for 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole is Cc1cc(-c2ccccc2OCc2ccccc2)on1.
What is the InChIKey of 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole?
The InChIKey is WDAVMBMFBORGAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-13-11-17(20-18-13)15-9-5-6-10-16(15)19-12-14-7-3-2-4-8-14/h2-11H,12H2,1H3.
What are the key properties of 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole?
3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole has a molecular weight of 265.31 g/mol, XLogP of 4.23, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(2-phenylmethoxyphenyl)-1,2-oxazole is sourced from PubChem (CID 164614812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).