2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol

C₁₁H₁₅NOS — CID 131001076

About 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol

2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol (PubChem CID 131001076) has the molecular formula C₁₁H₁₅NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol.

Molecular Properties

• Compound Name: 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol
• PubChem CID: 131001076
• Molecular Formula: C₁₁H₁₅NOS
• Molecular Weight: 209.31 g/mol
• Exact Mass: 209.09
• IUPAC Name: 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol
• SMILES: Cc1nc(C(O)CC2=CCCC2)cs1
• InChI: InChI=1S/C11H15NOS/c1-8-12-10(7-14-8)11(13)6-9-4-2-3-5-9/h4,7,11,13H,2-3,5-6H2,1H3
• InChIKey: OYCPMRGMOOFIGD-UHFFFAOYSA-N
• XLogP: 2.99
• TPSA: 33.12 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 14
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	209.31
LogP ≤ 5	2.99
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol?

The IUPAC name of 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol (CID 131001076) is 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol.

What is the SMILES notation for 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol?

The canonical SMILES for 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol is Cc1nc(C(O)CC2=CCCC2)cs1.

What is the InChIKey of 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol?

The InChIKey is OYCPMRGMOOFIGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NOS/c1-8-12-10(7-14-8)11(13)6-9-4-2-3-5-9/h4,7,11,13H,2-3,5-6H2,1H3.

What are the key properties of 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol?

2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol has a molecular weight of 209.31 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol is sourced from PubChem (CID 131001076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 131001076 — identifiers, structure, computed properties (public domain)

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