4-methoxy-2-thiophen-2-yl-1,3-oxazole

C8H7NO2S — CID 174374567

IUPAC4-methoxy-2-thiophen-2-yl-1,3-oxazole
SMILESCOc1coc(-c2cccs2)n1
InChIInChI=1S/C8H7NO2S/c1-10-7-5-11-8(9-7)6-3-2-4-12-6/h2-5H,1H3
InChIKeyLVNBEFPHWMKQLT-UHFFFAOYSA-N
MW181.22 g/mol
LogP2.41
Rot. Bonds2

About 4-methoxy-2-thiophen-2-yl-1,3-oxazole

4-methoxy-2-thiophen-2-yl-1,3-oxazole (PubChem CID 174374567) has the molecular formula C8H7NO2S and a molecular weight of 181.22 g/mol. Its IUPAC name is 4-methoxy-2-thiophen-2-yl-1,3-oxazole.

Molecular Properties

Compound Name4-methoxy-2-thiophen-2-yl-1,3-oxazole
PubChem CID174374567
Molecular FormulaC8H7NO2S
Molecular Weight181.22 g/mol
Exact Mass181.02
IUPAC Name4-methoxy-2-thiophen-2-yl-1,3-oxazole
SMILESCOc1coc(-c2cccs2)n1
InChIInChI=1S/C8H7NO2S/c1-10-7-5-11-8(9-7)6-3-2-4-12-6/h2-5H,1H3
InChIKeyLVNBEFPHWMKQLT-UHFFFAOYSA-N
XLogP2.41
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.22
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(chloromethyl)-2-thiophen-2-yl-1,3-oxazole
CID 2529531
2-methoxy-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]ethanamine
CID 60671128
2-(2-thiophen-2-yl-1,3-oxazol-4-yl)propan-1-amine
CID 115083577
2-(2-thiophen-2-yl-1,3-oxazol-4-yl)propan-1-ol
CID 115083578
2-thiophen-2-yl-1,3-oxazole-4-carboxamide
CID 140775055
2-(2-thiophen-2-yl-1,3-oxazol-4-yl)acetonitrile
CID 26695420
1-[3-methoxy-4-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]phenyl]ethanone
CID 26054578
4-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-2-thiophen-2-yl-1,3-oxazole
CID 7896504
methyl 3-methoxy-4-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzoate
CID 17420011
N'-methyl-N'-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]ethane-1,2-diamine
CID 62686633
4-methoxy-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methoxy]benzamide
CID 18166113
3-(2-thiophen-2-yl-1,3-oxazol-4-yl)propanoic acid
CID 82287085

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-thiophen-2-yl-1,3-oxazole?
The IUPAC name of 4-methoxy-2-thiophen-2-yl-1,3-oxazole (CID 174374567) is 4-methoxy-2-thiophen-2-yl-1,3-oxazole.
What is the SMILES notation for 4-methoxy-2-thiophen-2-yl-1,3-oxazole?
The canonical SMILES for 4-methoxy-2-thiophen-2-yl-1,3-oxazole is COc1coc(-c2cccs2)n1.
What is the InChIKey of 4-methoxy-2-thiophen-2-yl-1,3-oxazole?
The InChIKey is LVNBEFPHWMKQLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NO2S/c1-10-7-5-11-8(9-7)6-3-2-4-12-6/h2-5H,1H3.
What are the key properties of 4-methoxy-2-thiophen-2-yl-1,3-oxazole?
4-methoxy-2-thiophen-2-yl-1,3-oxazole has a molecular weight of 181.22 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-thiophen-2-yl-1,3-oxazole is sourced from PubChem (CID 174374567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).