2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol

C11H17NOS — CID 79424345

IUPAC2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol
SMILESCc1ncsc1CCC1CCCC1O
InChIInChI=1S/C11H17NOS/c1-8-11(14-7-12-8)6-5-9-3-2-4-10(9)13/h7,9-10,13H,2-6H2,1H3
InChIKeyXTMGKZBJFLKHDX-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.55
Rot. Bonds3

About 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol

2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol (PubChem CID 79424345) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol
PubChem CID79424345
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol
SMILESCc1ncsc1CCC1CCCC1O
InChIInChI=1S/C11H17NOS/c1-8-11(14-7-12-8)6-5-9-3-2-4-10(9)13/h7,9-10,13H,2-6H2,1H3
InChIKeyXTMGKZBJFLKHDX-UHFFFAOYSA-N
XLogP2.55
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol?
The IUPAC name of 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol (CID 79424345) is 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol?
The canonical SMILES for 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol is Cc1ncsc1CCC1CCCC1O.
What is the InChIKey of 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol?
The InChIKey is XTMGKZBJFLKHDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-8-11(14-7-12-8)6-5-9-3-2-4-10(9)13/h7,9-10,13H,2-6H2,1H3.
What are the key properties of 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol?
2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol has a molecular weight of 211.33 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]cyclopentan-1-ol is sourced from PubChem (CID 79424345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).