2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole

C8H11NS — CID 89420095

IUPAC2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESCc1nc2c(s1)CCC2C
InChIInChI=1S/C8H11NS/c1-5-3-4-7-8(5)9-6(2)10-7/h5H,3-4H2,1-2H3
InChIKeyWALXCFRFOHBIBH-UHFFFAOYSA-N
MW153.25 g/mol
LogP2.50
Rot. Bonds

About 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole

2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (PubChem CID 89420095) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.

Molecular Properties

Compound Name2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
PubChem CID89420095
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC Name2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESCc1nc2c(s1)CCC2C
InChIInChI=1S/C8H11NS/c1-5-3-4-7-8(5)9-6(2)10-7/h5H,3-4H2,1-2H3
InChIKeyWALXCFRFOHBIBH-UHFFFAOYSA-N
XLogP2.50
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][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 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The IUPAC name of 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (CID 89420095) is 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.
What is the SMILES notation for 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The canonical SMILES for 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is Cc1nc2c(s1)CCC2C.
What is the InChIKey of 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The InChIKey is WALXCFRFOHBIBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NS/c1-5-3-4-7-8(5)9-6(2)10-7/h5H,3-4H2,1-2H3.
What are the key properties of 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole has a molecular weight of 153.25 g/mol, XLogP of 2.50, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is sourced from PubChem (CID 89420095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).