3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole

C9H10N2OS — CID 59259263

IUPAC3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole
SMILESCCc1csc(-c2cc(C)on2)n1
InChIInChI=1S/C9H10N2OS/c1-3-7-5-13-9(10-7)8-4-6(2)12-11-8/h4-5H,3H2,1-2H3
InChIKeyDDPYWTHUCFMKKO-UHFFFAOYSA-N
MW194.26 g/mol
LogP2.67
Rot. Bonds2

About 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole

3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole (PubChem CID 59259263) has the molecular formula C9H10N2OS and a molecular weight of 194.26 g/mol. Its IUPAC name is 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole.

Molecular Properties

Compound Name3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole
PubChem CID59259263
Molecular FormulaC9H10N2OS
Molecular Weight194.26 g/mol
Exact Mass194.05
IUPAC Name3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole
SMILESCCc1csc(-c2cc(C)on2)n1
InChIInChI=1S/C9H10N2OS/c1-3-7-5-13-9(10-7)8-4-6(2)12-11-8/h4-5H,3H2,1-2H3
InChIKeyDDPYWTHUCFMKKO-UHFFFAOYSA-N
XLogP2.67
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole?
The IUPAC name of 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole (CID 59259263) is 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole.
What is the SMILES notation for 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole?
The canonical SMILES for 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole is CCc1csc(-c2cc(C)on2)n1.
What is the InChIKey of 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole?
The InChIKey is DDPYWTHUCFMKKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2OS/c1-3-7-5-13-9(10-7)8-4-6(2)12-11-8/h4-5H,3H2,1-2H3.
What are the key properties of 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole?
3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole has a molecular weight of 194.26 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethyl-1,3-thiazol-2-yl)-5-methyl-1,2-oxazole is sourced from PubChem (CID 59259263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).