5-ethyl-2-methyl-4-propyl-1,3-thiazole

C9H15NS — CID 588155

IUPAC5-ethyl-2-methyl-4-propyl-1,3-thiazole
SMILESCCCc1nc(C)sc1CC
InChIInChI=1S/C9H15NS/c1-4-6-8-9(5-2)11-7(3)10-8/h4-6H2,1-3H3
InChIKeyYTFYPHBAFRPICF-UHFFFAOYSA-N
MW169.29 g/mol
LogP2.97
Rot. Bonds3

About 5-ethyl-2-methyl-4-propyl-1,3-thiazole

5-ethyl-2-methyl-4-propyl-1,3-thiazole (PubChem CID 588155) has the molecular formula C9H15NS and a molecular weight of 169.29 g/mol. Its IUPAC name is 5-ethyl-2-methyl-4-propyl-1,3-thiazole.

Molecular Properties

Compound Name5-ethyl-2-methyl-4-propyl-1,3-thiazole
PubChem CID588155
Molecular FormulaC9H15NS
Molecular Weight169.29 g/mol
Exact Mass169.09
IUPAC Name5-ethyl-2-methyl-4-propyl-1,3-thiazole
SMILESCCCc1nc(C)sc1CC
InChIInChI=1S/C9H15NS/c1-4-6-8-9(5-2)11-7(3)10-8/h4-6H2,1-3H3
InChIKeyYTFYPHBAFRPICF-UHFFFAOYSA-N
XLogP2.97
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.29
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-ethyl-2-methyl-4-propyl-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methyl-4-propyl-1,3-thiazole?
The IUPAC name of 5-ethyl-2-methyl-4-propyl-1,3-thiazole (CID 588155) is 5-ethyl-2-methyl-4-propyl-1,3-thiazole.
What is the SMILES notation for 5-ethyl-2-methyl-4-propyl-1,3-thiazole?
The canonical SMILES for 5-ethyl-2-methyl-4-propyl-1,3-thiazole is CCCc1nc(C)sc1CC.
What is the InChIKey of 5-ethyl-2-methyl-4-propyl-1,3-thiazole?
The InChIKey is YTFYPHBAFRPICF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NS/c1-4-6-8-9(5-2)11-7(3)10-8/h4-6H2,1-3H3.
What are the key properties of 5-ethyl-2-methyl-4-propyl-1,3-thiazole?
5-ethyl-2-methyl-4-propyl-1,3-thiazole has a molecular weight of 169.29 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methyl-4-propyl-1,3-thiazole is sourced from PubChem (CID 588155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).