5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole

C9H9NOS2 — CID 116887500

IUPAC5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole
SMILESCOc1sc(-c2cccs2)nc1C
InChIInChI=1S/C9H9NOS2/c1-6-9(11-2)13-8(10-6)7-4-3-5-12-7/h3-5H,1-2H3
InChIKeyHPQZBCJPVAPFSK-UHFFFAOYSA-N
MW211.31 g/mol
LogP3.19
Rot. Bonds2

About 5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole

5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole (PubChem CID 116887500) has the molecular formula C9H9NOS2 and a molecular weight of 211.31 g/mol. Its IUPAC name is 5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole.

Molecular Properties

Compound Name5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole
PubChem CID116887500
Molecular FormulaC9H9NOS2
Molecular Weight211.31 g/mol
Exact Mass211.01
IUPAC Name5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole
SMILESCOc1sc(-c2cccs2)nc1C
InChIInChI=1S/C9H9NOS2/c1-6-9(11-2)13-8(10-6)7-4-3-5-12-7/h3-5H,1-2H3
InChIKeyHPQZBCJPVAPFSK-UHFFFAOYSA-N
XLogP3.19
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(chloromethyl)-4-methyl-2-thiophen-2-yl-1,3-thiazole
CID 82081726
4-methyl-2-thiophen-2-yl-1,3-thiazole-5-sulfonyl chloride
CID 82093836
4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carbothioamide
CID 82427273
2-(4-fluorophenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887509
2-(4-methyl-2-thiophen-2-yl-1,3-thiazol-5-yl)butanoic acid
CID 116887132
ethane;2-(4-methoxyphenyl)-5-thiophen-2-yl-1,3,4-thiadiazole
CID 177007601
1-[(4-methoxyphenyl)methyl]-3-[(4-methyl-2-thiophen-2-yl-1,3-thiazol-5-yl)methyl]urea
CID 90546957
(4-methoxycarbonylphenyl) 4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carboxylate
CID 7668495
4-(4-methyl-2-thiophen-2-yl-1,3-thiazol-5-yl)butan-2-amine
CID 116884857
3-(4-methyl-2-thiophen-2-yl-1,3-thiazol-5-yl)butan-1-amine
CID 116884789
2-methoxy-N-[(4-methyl-2-thiophen-2-yl-1,3-thiazol-5-yl)methyl]benzamide
CID 90546701
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carboxamide
CID 103895328

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole?
The IUPAC name of 5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole (CID 116887500) is 5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole.
What is the SMILES notation for 5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole?
The canonical SMILES for 5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole is COc1sc(-c2cccs2)nc1C.
What is the InChIKey of 5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole?
The InChIKey is HPQZBCJPVAPFSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NOS2/c1-6-9(11-2)13-8(10-6)7-4-3-5-12-7/h3-5H,1-2H3.
What are the key properties of 5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole?
5-methoxy-4-methyl-2-thiophen-2-yl-1,3-thiazole has a molecular weight of 211.31 g/mol, XLogP of 3.19, 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-thiophen-2-yl-1,3-thiazole is sourced from PubChem (CID 116887500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).