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

C10H12N2OS2 — CID 86037500

IUPAC3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole
SMILESCc1cc(COCc2cc(C)ns2)sn1
InChIInChI=1S/C10H12N2OS2/c1-7-3-9(14-11-7)5-13-6-10-4-8(2)12-15-10/h3-4H,5-6H2,1-2H3
InChIKeyCSNGNNPECILFRE-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.93
Rot. Bonds4

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

3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole (PubChem CID 86037500) has the molecular formula C10H12N2OS2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole.

Molecular Properties

Compound Name3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole
PubChem CID86037500
Molecular FormulaC10H12N2OS2
Molecular Weight240.35 g/mol
Exact Mass240.04
IUPAC Name3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole
SMILESCc1cc(COCc2cc(C)ns2)sn1
InChIInChI=1S/C10H12N2OS2/c1-7-3-9(14-11-7)5-13-6-10-4-8(2)12-15-10/h3-4H,5-6H2,1-2H3
InChIKeyCSNGNNPECILFRE-UHFFFAOYSA-N
XLogP2.93
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(3-Methyl-1,2-thiazol-5-yl)methyl 3-methyl-1,2-thiazole-5-carboxylate
CID 57879633
5-(Methoxymethyl)-3-methyl-1,2-thiazole
CID 58602875
3-Methyl-5-(propan-2-yloxymethyl)-1,2-thiazole
CID 171731875
3-[(3-Methyl-1,2-thiazol-5-yl)methoxy]propanenitrile
CID 86037610

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole?
The IUPAC name of 3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole (CID 86037500) is 3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole.
What is the SMILES notation for 3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole?
The canonical SMILES for 3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole is Cc1cc(COCc2cc(C)ns2)sn1.
What is the InChIKey of 3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole?
The InChIKey is CSNGNNPECILFRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2OS2/c1-7-3-9(14-11-7)5-13-6-10-4-8(2)12-15-10/h3-4H,5-6H2,1-2H3.
What are the key properties of 3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole?
3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole has a molecular weight of 240.35 g/mol, XLogP of 2.93, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-[(3-methyl-1,2-thiazol-5-yl)methoxymethyl]-1,2-thiazole is sourced from PubChem (CID 86037500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).