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

C10H15NS — CID 130511874

IUPAC2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESCCc1nc2c(s1)CCC2CC
InChIInChI=1S/C10H15NS/c1-3-7-5-6-8-10(7)11-9(4-2)12-8/h7H,3-6H2,1-2H3
InChIKeyWQAZDYSDLFQZAA-UHFFFAOYSA-N
MW181.30 g/mol
LogP3.15
Rot. Bonds2

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

2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (PubChem CID 130511874) has the molecular formula C10H15NS and a molecular weight of 181.30 g/mol. Its IUPAC name is 2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.

Molecular Properties

Compound Name2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
PubChem CID130511874
Molecular FormulaC10H15NS
Molecular Weight181.30 g/mol
Exact Mass181.09
IUPAC Name2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESCCc1nc2c(s1)CCC2CC
InChIInChI=1S/C10H15NS/c1-3-7-5-6-8-10(7)11-9(4-2)12-8/h7H,3-6H2,1-2H3
InChIKeyWQAZDYSDLFQZAA-UHFFFAOYSA-N
XLogP3.15
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.30
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The IUPAC name of 2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (CID 130511874) is 2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.
What is the SMILES notation for 2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The canonical SMILES for 2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is CCc1nc2c(s1)CCC2CC.
What is the InChIKey of 2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The InChIKey is WQAZDYSDLFQZAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NS/c1-3-7-5-6-8-10(7)11-9(4-2)12-8/h7H,3-6H2,1-2H3.
What are the key properties of 2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole has a molecular weight of 181.30 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diethyl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is sourced from PubChem (CID 130511874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).