3,5-diethyl-1,2-thiazole

C7H11NS — CID 15621350

IUPAC3,5-diethyl-1,2-thiazole
SMILESCCc1cc(CC)sn1
InChIInChI=1S/C7H11NS/c1-3-6-5-7(4-2)9-8-6/h5H,3-4H2,1-2H3
InChIKeyKGTVWXIFRFMRQK-UHFFFAOYSA-N
MW141.24 g/mol
LogP2.27
Rot. Bonds2

About 3,5-diethyl-1,2-thiazole

3,5-diethyl-1,2-thiazole (PubChem CID 15621350) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is 3,5-diethyl-1,2-thiazole.

Molecular Properties

Compound Name3,5-diethyl-1,2-thiazole
PubChem CID15621350
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC Name3,5-diethyl-1,2-thiazole
SMILESCCc1cc(CC)sn1
InChIInChI=1S/C7H11NS/c1-3-6-5-7(4-2)9-8-6/h5H,3-4H2,1-2H3
InChIKeyKGTVWXIFRFMRQK-UHFFFAOYSA-N
XLogP2.27
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3,5-diethyl-1,2-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 3,5-diethyl-1,2-thiazole?
The IUPAC name of 3,5-diethyl-1,2-thiazole (CID 15621350) is 3,5-diethyl-1,2-thiazole.
What is the SMILES notation for 3,5-diethyl-1,2-thiazole?
The canonical SMILES for 3,5-diethyl-1,2-thiazole is CCc1cc(CC)sn1.
What is the InChIKey of 3,5-diethyl-1,2-thiazole?
The InChIKey is KGTVWXIFRFMRQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NS/c1-3-6-5-7(4-2)9-8-6/h5H,3-4H2,1-2H3.
What are the key properties of 3,5-diethyl-1,2-thiazole?
3,5-diethyl-1,2-thiazole has a molecular weight of 141.24 g/mol, XLogP of 2.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-1,2-thiazole is sourced from PubChem (CID 15621350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).