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

C11H15NOS — CID 131001076

IUPAC2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol
SMILESCc1nc(C(O)CC2=CCCC2)cs1
InChIInChI=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
InChIKeyOYCPMRGMOOFIGD-UHFFFAOYSA-N
MW209.31 g/mol
LogP2.99
Rot. Bonds3

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 Name2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol
PubChem CID131001076
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC Name2-(cyclopenten-1-yl)-1-(2-methyl-1,3-thiazol-4-yl)ethanol
SMILESCc1nc(C(O)CC2=CCCC2)cs1
InChIInChI=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
InChIKeyOYCPMRGMOOFIGD-UHFFFAOYSA-N
XLogP2.99
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1R)-2-amino-1-(2-methyl-1,3-thiazol-4-yl)ethanol
CID 28819519
1-(2-methyl-1,3-thiazol-4-yl)-2-(4-propan-2-ylphenyl)ethanol
CID 113472332
1-(cyclohexen-1-yl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-ol
CID 116660126
4-methyl-1-(2-methyl-1,3-thiazol-4-yl)pent-4-en-1-ol
CID 105127443
2-iodo-2-(2-methyl-1,3-thiazol-4-yl)ethanol
CID 137495706
1-(cyclohexen-1-yl)-2-deuteriopropan-2-ol
CID 12622752
1-(2-methyl-1,3-thiazol-4-yl)hex-5-en-1-ol
CID 105102094
1-(4-tert-butylphenyl)-2-(cyclohexen-1-yl)ethanol
CID 116660093
2-(2-methyl-1,3-thiazol-4-yl)propane-1,3-diol
CID 58328504
2-(cyclohexen-1-yl)-1-(6-methyl-3-pyridinyl)ethanol
CID 116660276
2-(2-methyl-1,3-thiazol-4-yl)butan-1-ol
CID 116891275
(1R,2S)-1-amino-1-(2-methyl-1,3-thiazol-4-yl)propan-2-ol
CID 124505318

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).