2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol

C9H10N2OS — CID 22324780

IUPAC2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol
SMILESOC(Cc1ncc[nH]1)c1cccs1
InChIInChI=1S/C9H10N2OS/c12-7(8-2-1-5-13-8)6-9-10-3-4-11-9/h1-5,7,12H,6H2,(H,10,11)
InChIKeyDFIQOCPWPIHCIN-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.75
Rot. Bonds3

About 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol

2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol (PubChem CID 22324780) has the molecular formula C9H10N2OS and a molecular weight of 194.26 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol
PubChem CID22324780
Molecular FormulaC9H10N2OS
Molecular Weight194.26 g/mol
Exact Mass194.05
IUPAC Name2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol
SMILESOC(Cc1ncc[nH]1)c1cccs1
InChIInChI=1S/C9H10N2OS/c12-7(8-2-1-5-13-8)6-9-10-3-4-11-9/h1-5,7,12H,6H2,(H,10,11)
InChIKeyDFIQOCPWPIHCIN-UHFFFAOYSA-N
XLogP1.75
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chlorophenyl)-2-(1H-imidazol-2-yl)ethanol
CID 22324903
1-(6-fluoro-1-benzothiophen-2-yl)-2-(1H-imidazol-2-yl)ethanol
CID 81104324
1-(3-bromophenyl)-2-(1H-imidazol-2-yl)ethanol
CID 61080867
2-(1-methylimidazol-2-yl)-1-thiophen-2-ylethanol
CID 79745049
1-(4-ethylphenyl)-2-(1H-imidazol-2-yl)ethanol
CID 61082232
1-(3,4-dimethylphenyl)-2-(1H-imidazol-2-yl)ethanol
CID 61083210
2-(1H-imidazol-2-yl)-1-(3-methoxyphenyl)ethanol
CID 61080490
1-(2,5-dichlorothiophen-3-yl)-2-(1H-imidazol-2-yl)ethanol
CID 107964204
1-(2,5-dimethylphenyl)-2-(1H-imidazol-2-yl)ethanol
CID 61082230
(1S)-3-imidazol-1-yl-1-thiophen-2-ylpropan-1-ol
CID 129406015
2-bromo-1-thiophen-2-ylethanol
CID 22324999
(1S)-2-chloro-1-thiophen-2-ylethanol
CID 15981658

Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol?
The IUPAC name of 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol (CID 22324780) is 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol.
What is the SMILES notation for 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol?
The canonical SMILES for 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol is OC(Cc1ncc[nH]1)c1cccs1.
What is the InChIKey of 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol?
The InChIKey is DFIQOCPWPIHCIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2OS/c12-7(8-2-1-5-13-8)6-9-10-3-4-11-9/h1-5,7,12H,6H2,(H,10,11).
What are the key properties of 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol?
2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol has a molecular weight of 194.26 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)-1-thiophen-2-ylethanol is sourced from PubChem (CID 22324780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).