2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole

C11H17NS — CID 146290468

IUPAC2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole
SMILESCc1nc(C)c(C2(C)CCCC2)s1
InChIInChI=1S/C11H17NS/c1-8-10(13-9(2)12-8)11(3)6-4-5-7-11/h4-7H2,1-3H3
InChIKeyULXXACUBJHPYEW-UHFFFAOYSA-N
MW195.33 g/mol
LogP3.59
Rot. Bonds1

About 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole

2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole (PubChem CID 146290468) has the molecular formula C11H17NS and a molecular weight of 195.33 g/mol. Its IUPAC name is 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole.

Molecular Properties

Compound Name2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole
PubChem CID146290468
Molecular FormulaC11H17NS
Molecular Weight195.33 g/mol
Exact Mass195.11
IUPAC Name2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole
SMILESCc1nc(C)c(C2(C)CCCC2)s1
InChIInChI=1S/C11H17NS/c1-8-10(13-9(2)12-8)11(3)6-4-5-7-11/h4-7H2,1-3H3
InChIKeyULXXACUBJHPYEW-UHFFFAOYSA-N
XLogP3.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.33
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole?
The IUPAC name of 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole (CID 146290468) is 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole.
What is the SMILES notation for 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole?
The canonical SMILES for 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole is Cc1nc(C)c(C2(C)CCCC2)s1.
What is the InChIKey of 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole?
The InChIKey is ULXXACUBJHPYEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NS/c1-8-10(13-9(2)12-8)11(3)6-4-5-7-11/h4-7H2,1-3H3.
What are the key properties of 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole?
2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole has a molecular weight of 195.33 g/mol, XLogP of 3.59, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-5-(1-methylcyclopentyl)-1,3-thiazole is sourced from PubChem (CID 146290468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).