2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole

C15H13NO2S — CID 14424352

IUPAC2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole
SMILESCOc1ccc(-c2ncc(-c3ccc(C)s3)o2)cc1
InChIInChI=1S/C15H13NO2S/c1-10-3-8-14(19-10)13-9-16-15(18-13)11-4-6-12(17-2)7-5-11/h3-9H,1-2H3
InChIKeyWDDLVVKZYKUNLR-UHFFFAOYSA-N
MW271.34 g/mol
LogP4.39
Rot. Bonds3

About 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole

2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole (PubChem CID 14424352) has the molecular formula C15H13NO2S and a molecular weight of 271.34 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole
PubChem CID14424352
Molecular FormulaC15H13NO2S
Molecular Weight271.34 g/mol
Exact Mass271.07
IUPAC Name2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole
SMILESCOc1ccc(-c2ncc(-c3ccc(C)s3)o2)cc1
InChIInChI=1S/C15H13NO2S/c1-10-3-8-14(19-10)13-9-16-15(18-13)11-4-6-12(17-2)7-5-11/h3-9H,1-2H3
InChIKeyWDDLVVKZYKUNLR-UHFFFAOYSA-N
XLogP4.39
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-Fluorophenyl)-2-thiophen-2-yloxazole
CID 856373
5-(4-Methoxyphenyl)-2-phenyloxazole
CID 5325928
2-(4-Methoxyphenyl)-5-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3,4-oxadiazole
CID 2562839
1-[[4-Ethyl-5-[5-(4-phenoxyphenyl)-1,3-oxazol-2-yl]thiophen-2-yl]methyl]azetidine-3-carboxylic acid
CID 70683465
1-[[4-Ethyl-5-[2-(4-phenoxyphenyl)-1,3-oxazol-5-yl]thiophen-2-yl]methyl]azetidine-3-carboxylic acid
CID 70696095
2-methoxy-5-oxazol-5-yl-N-(2-thienylmethyl)aniline
CID 73347890
2-methoxy-N-[(5-methyl-2-thienyl)methyl]-5-oxazol-5-yl-aniline
CID 73353928
2-(4-Methoxyphenyl)-5-phenyl-1,3-oxazole
CID 798929
5-Phenyl-2-(thiophen-2-YL)oxazole
CID 4303653
2-({[2-(4-Ethoxyphenyl)-5-methyl-1,3-oxazol-4-YL]methyl}sulfanyl)-N-[(thiophen-2-YL)methyl]acetamide
CID 4174349
2,5-Bis(4-methoxyphenyl)oxazole
CID 13404049
2-[2-(4-Methoxyphenyl)-5-thiophen-3-yl-1,3-oxazol-4-yl]acetic acid
CID 13583354

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole?
The IUPAC name of 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole (CID 14424352) is 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole?
The canonical SMILES for 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole is COc1ccc(-c2ncc(-c3ccc(C)s3)o2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole?
The InChIKey is WDDLVVKZYKUNLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2S/c1-10-3-8-14(19-10)13-9-16-15(18-13)11-4-6-12(17-2)7-5-11/h3-9H,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole?
2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole has a molecular weight of 271.34 g/mol, XLogP of 4.39, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole is sourced from PubChem (CID 14424352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).