5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole

C10H11NO2S — CID 116887586

IUPAC5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole
SMILESCOc1sc(-c2ccc(C)o2)nc1C
InChIInChI=1S/C10H11NO2S/c1-6-4-5-8(13-6)9-11-7(2)10(12-3)14-9/h4-5H,1-3H3
InChIKeyYSWYSSURKSIESL-UHFFFAOYSA-N
MW209.27 g/mol
LogP3.03
Rot. Bonds2

About 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole

5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole (PubChem CID 116887586) has the molecular formula C10H11NO2S and a molecular weight of 209.27 g/mol. Its IUPAC name is 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole
PubChem CID116887586
Molecular FormulaC10H11NO2S
Molecular Weight209.27 g/mol
Exact Mass209.05
IUPAC Name5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole
SMILESCOc1sc(-c2ccc(C)o2)nc1C
InChIInChI=1S/C10H11NO2S/c1-6-4-5-8(13-6)9-11-7(2)10(12-3)14-9/h4-5H,1-3H3
InChIKeyYSWYSSURKSIESL-UHFFFAOYSA-N
XLogP3.03
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]acetate
CID 116886343
N-methyl-1-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]methanamine
CID 116868204
N-methyl-1-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]ethanamine
CID 61282283
2-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]ethanol
CID 116885384
3-methyl-2-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]butanenitrile
CID 116887338
methyl 5-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole-4-carboxylate
CID 115422266
2-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]butanenitrile
CID 116887313
1-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]propan-2-amine
CID 116884656
2-(4-fluorophenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887509
2-methyl-2-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]propanoic acid
CID 116885480
2-(4-ethoxyphenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887536
2-(2,5-dimethoxyphenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887517

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole?
The IUPAC name of 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole (CID 116887586) is 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole.
What is the SMILES notation for 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole?
The canonical SMILES for 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole is COc1sc(-c2ccc(C)o2)nc1C.
What is the InChIKey of 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole?
The InChIKey is YSWYSSURKSIESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2S/c1-6-4-5-8(13-6)9-11-7(2)10(12-3)14-9/h4-5H,1-3H3.
What are the key properties of 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole?
5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole has a molecular weight of 209.27 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole is sourced from PubChem (CID 116887586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).