2-thiophen-3-ylcyclopent-3-en-1-ol

C9H10OS — CID 75219436

IUPAC2-thiophen-3-ylcyclopent-3-en-1-ol
SMILESOC1CC=CC1c1ccsc1
InChIInChI=1S/C9H10OS/c10-9-3-1-2-8(9)7-4-5-11-6-7/h1-2,4-6,8-10H,3H2
InChIKeyZTOGPHNJFCEPJC-UHFFFAOYSA-N
MW166.25 g/mol
LogP2.15
Rot. Bonds1

About 2-thiophen-3-ylcyclopent-3-en-1-ol

2-thiophen-3-ylcyclopent-3-en-1-ol (PubChem CID 75219436) has the molecular formula C9H10OS and a molecular weight of 166.25 g/mol. Its IUPAC name is 2-thiophen-3-ylcyclopent-3-en-1-ol.

Molecular Properties

Compound Name2-thiophen-3-ylcyclopent-3-en-1-ol
PubChem CID75219436
Molecular FormulaC9H10OS
Molecular Weight166.25 g/mol
Exact Mass166.05
IUPAC Name2-thiophen-3-ylcyclopent-3-en-1-ol
SMILESOC1CC=CC1c1ccsc1
InChIInChI=1S/C9H10OS/c10-9-3-1-2-8(9)7-4-5-11-6-7/h1-2,4-6,8-10H,3H2
InChIKeyZTOGPHNJFCEPJC-UHFFFAOYSA-N
XLogP2.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl [(1R,2S)-2-thiophen-3-ylcyclopent-3-en-1-yl] carbonate
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5-thiophen-3-yl-4,5-dihydro-1,2-oxazole
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8-azabicyclo[3.2.1]oct-2-en-8-yl(thiophen-3-yl)methanone
CID 72720082
2-thiophen-3-ylcyclobutan-1-amine
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3-thiophen-3-ylpiperazin-2-one
CID 62352453
1-(2-thiophen-3-ylcyclopropyl)ethanol
CID 53275681
1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone
CID 167980764
N-methyl-1-(2-thiophen-3-ylcyclopropyl)methanamine
CID 53275665
3-(3-bromocyclopentyl)thiophene
CID 65102125
3-[(1R,2R)-2-(chloromethyl)cyclopropyl]thiophene
CID 67942354
[(1R,2R)-2-thiophen-3-ylcyclopropyl]methanamine
CID 94556777

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-3-ylcyclopent-3-en-1-ol?
The IUPAC name of 2-thiophen-3-ylcyclopent-3-en-1-ol (CID 75219436) is 2-thiophen-3-ylcyclopent-3-en-1-ol.
What is the SMILES notation for 2-thiophen-3-ylcyclopent-3-en-1-ol?
The canonical SMILES for 2-thiophen-3-ylcyclopent-3-en-1-ol is OC1CC=CC1c1ccsc1.
What is the InChIKey of 2-thiophen-3-ylcyclopent-3-en-1-ol?
The InChIKey is ZTOGPHNJFCEPJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10OS/c10-9-3-1-2-8(9)7-4-5-11-6-7/h1-2,4-6,8-10H,3H2.
What are the key properties of 2-thiophen-3-ylcyclopent-3-en-1-ol?
2-thiophen-3-ylcyclopent-3-en-1-ol has a molecular weight of 166.25 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-3-ylcyclopent-3-en-1-ol is sourced from PubChem (CID 75219436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).