1-(2-thiophen-2-ylcyclopropyl)ethanol

C9H12OS — CID 53275688

IUPAC1-(2-thiophen-2-ylcyclopropyl)ethanol
SMILESCC(O)C1CC1c1cccs1
InChIInChI=1S/C9H12OS/c1-6(10)7-5-8(7)9-3-2-4-11-9/h2-4,6-8,10H,5H2,1H3
InChIKeyXHDAKSVCDXTSFX-UHFFFAOYSA-N
MW168.26 g/mol
LogP2.23
Rot. Bonds2

About 1-(2-thiophen-2-ylcyclopropyl)ethanol

1-(2-thiophen-2-ylcyclopropyl)ethanol (PubChem CID 53275688) has the molecular formula C9H12OS and a molecular weight of 168.26 g/mol. Its IUPAC name is 1-(2-thiophen-2-ylcyclopropyl)ethanol.

Molecular Properties

Compound Name1-(2-thiophen-2-ylcyclopropyl)ethanol
PubChem CID53275688
Molecular FormulaC9H12OS
Molecular Weight168.26 g/mol
Exact Mass168.06
IUPAC Name1-(2-thiophen-2-ylcyclopropyl)ethanol
SMILESCC(O)C1CC1c1cccs1
InChIInChI=1S/C9H12OS/c1-6(10)7-5-8(7)9-3-2-4-11-9/h2-4,6-8,10H,5H2,1H3
InChIKeyXHDAKSVCDXTSFX-UHFFFAOYSA-N
XLogP2.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.26
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-thiophen-2-ylcyclopropyl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-thiophen-2-ylcyclohexyl)propanoic acid
CID 82243540
ethyl 3-oxo-2-(2-thiophen-2-ylcyclopropyl)propanoate
CID 88519357
cis-(1R,2S)-2-thiophen-2-ylcyclopropan-1-amine
CID 28901769
2-(2-thiophen-2-ylcyclohexyl)propan-1-amine
CID 82242346
2-(2-thiophen-2-ylcycloheptyl)propan-1-amine
CID 82243482
(1R)-1-[(1S,2S)-2-(2-fluorophenyl)cyclopropyl]ethanol
CID 28912159
(1S)-1-[(1S,2S)-2-(2-fluorophenyl)cyclopropyl]ethanol
CID 28912160
1-(2-thiophen-2-ylcyclopropyl)cyclopropan-1-ol
CID 69063491
(3R,4R)-4-thiophen-2-yloxolan-3-ol
CID 97036334
(1R)-1-[(1S,2S)-2-(4-methylphenyl)cyclopropyl]ethanol
CID 28912369
N,2-dimethyl-3-thiophen-2-ylcyclobutan-1-amine
CID 81417579
(3aS,4S,6S,6aR)-2,2-dimethyl-6-thiophen-2-yl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-ol
CID 176778172

Frequently Asked Questions

What is the IUPAC name of 1-(2-thiophen-2-ylcyclopropyl)ethanol?
The IUPAC name of 1-(2-thiophen-2-ylcyclopropyl)ethanol (CID 53275688) is 1-(2-thiophen-2-ylcyclopropyl)ethanol.
What is the SMILES notation for 1-(2-thiophen-2-ylcyclopropyl)ethanol?
The canonical SMILES for 1-(2-thiophen-2-ylcyclopropyl)ethanol is CC(O)C1CC1c1cccs1.
What is the InChIKey of 1-(2-thiophen-2-ylcyclopropyl)ethanol?
The InChIKey is XHDAKSVCDXTSFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12OS/c1-6(10)7-5-8(7)9-3-2-4-11-9/h2-4,6-8,10H,5H2,1H3.
What are the key properties of 1-(2-thiophen-2-ylcyclopropyl)ethanol?
1-(2-thiophen-2-ylcyclopropyl)ethanol has a molecular weight of 168.26 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-thiophen-2-ylcyclopropyl)ethanol is sourced from PubChem (CID 53275688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).