3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole

C8H8N2S2 — CID 134094530

IUPAC3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole
SMILESCc1cc(-c2cc(C)ns2)sn1
InChIInChI=1S/C8H8N2S2/c1-5-3-7(11-9-5)8-4-6(2)10-12-8/h3-4H,1-2H3
InChIKeyVWZQISBUXDLLDN-UHFFFAOYSA-N
MW196.30 g/mol
LogP2.88
Rot. Bonds1

About 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole

3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole (PubChem CID 134094530) has the molecular formula C8H8N2S2 and a molecular weight of 196.30 g/mol. Its IUPAC name is 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole.

Molecular Properties

Compound Name3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole
PubChem CID134094530
Molecular FormulaC8H8N2S2
Molecular Weight196.30 g/mol
Exact Mass196.01
IUPAC Name3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole
SMILESCc1cc(-c2cc(C)ns2)sn1
InChIInChI=1S/C8H8N2S2/c1-5-3-7(11-9-5)8-4-6(2)10-12-8/h3-4H,1-2H3
InChIKeyVWZQISBUXDLLDN-UHFFFAOYSA-N
XLogP2.88
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.30
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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5-(3-methyl-1,2-thiazol-5-yl)-1,2,4-triazin-3-amine
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3-methyl-5-propan-2-yl-1,2-thiazole
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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole?
The IUPAC name of 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole (CID 134094530) is 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole.
What is the SMILES notation for 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole?
The canonical SMILES for 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole is Cc1cc(-c2cc(C)ns2)sn1.
What is the InChIKey of 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole?
The InChIKey is VWZQISBUXDLLDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2S2/c1-5-3-7(11-9-5)8-4-6(2)10-12-8/h3-4H,1-2H3.
What are the key properties of 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole?
3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole has a molecular weight of 196.30 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(3-methyl-1,2-thiazol-5-yl)-1,2-thiazole is sourced from PubChem (CID 134094530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).