2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole

C11H17NS — CID 58125059

IUPAC2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESCCc1nc2c(s1)CCC2C(C)C
InChIInChI=1S/C11H17NS/c1-4-10-12-11-8(7(2)3)5-6-9(11)13-10/h7-8H,4-6H2,1-3H3
InChIKeyFENDRLXTDXWWNV-UHFFFAOYSA-N
MW195.33 g/mol
LogP3.39
Rot. Bonds2

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

2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (PubChem CID 58125059) has the molecular formula C11H17NS and a molecular weight of 195.33 g/mol. Its IUPAC name is 2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.

Molecular Properties

Compound Name2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
PubChem CID58125059
Molecular FormulaC11H17NS
Molecular Weight195.33 g/mol
Exact Mass195.11
IUPAC Name2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
SMILESCCc1nc2c(s1)CCC2C(C)C
InChIInChI=1S/C11H17NS/c1-4-10-12-11-8(7(2)3)5-6-9(11)13-10/h7-8H,4-6H2,1-3H3
InChIKeyFENDRLXTDXWWNV-UHFFFAOYSA-N
XLogP3.39
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.33
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 112623630
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CID 163647146
CID 163647146
CID 163647147
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CID 58125084
CID 58125084
CID 89140365
CID 89140365
CID 89729313
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CID 142201070
CID 142201070
CID 167048182
CID 167048182
CID 12198349
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CID 20811744
CID 20811744

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The IUPAC name of 2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole (CID 58125059) is 2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole.
What is the SMILES notation for 2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The canonical SMILES for 2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is CCc1nc2c(s1)CCC2C(C)C.
What is the InChIKey of 2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
The InChIKey is FENDRLXTDXWWNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NS/c1-4-10-12-11-8(7(2)3)5-6-9(11)13-10/h7-8H,4-6H2,1-3H3.
What are the key properties of 2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole?
2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole has a molecular weight of 195.33 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole is sourced from PubChem (CID 58125059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).