1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol

C14H14O2 — CID 114724804

IUPAC1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol
SMILESOC1(c2cc3ccccc3o2)C=CCCC1
InChIInChI=1S/C14H14O2/c15-14(8-4-1-5-9-14)13-10-11-6-2-3-7-12(11)16-13/h2-4,6-8,10,15H,1,5,9H2
InChIKeyJAHAKCZIIFJVEW-UHFFFAOYSA-N
MW214.26 g/mol
LogP3.36
Rot. Bonds1

About 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol

1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol (PubChem CID 114724804) has the molecular formula C14H14O2 and a molecular weight of 214.26 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol
PubChem CID114724804
Molecular FormulaC14H14O2
Molecular Weight214.26 g/mol
Exact Mass214.10
IUPAC Name1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol
SMILESOC1(c2cc3ccccc3o2)C=CCCC1
InChIInChI=1S/C14H14O2/c15-14(8-4-1-5-9-14)13-10-11-6-2-3-7-12(11)16-13/h2-4,6-8,10,15H,1,5,9H2
InChIKeyJAHAKCZIIFJVEW-UHFFFAOYSA-N
XLogP3.36
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 53.36
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

1-(1-benzofuran-2-yl)-2,4,4-trimethylcyclohexan-1-ol
CID 114724396
6-(1-benzofuran-2-yl)bicyclo[3.1.0]hexan-6-amine
CID 79331489
1-(1-benzofuran-2-yl)-2-tert-butylcyclohexan-1-ol
CID 114722905
1-(1-benzofuran-2-yl)-4-fluoro-2,3-dihydroinden-1-ol
CID 114724678
1-(1-benzofuran-2-yl)-3,4-dimethylcyclohexan-1-ol
CID 114723885
1-(1-benzofuran-2-yl)-3-propan-2-ylcyclobutan-1-ol
CID 103564279
2-(3-chloro-1-methylcyclopentyl)-1-benzofuran
CID 114734023
2-(3-bromo-1-methylcyclopentyl)-1-benzofuran
CID 114734030
4-(1-benzofuran-2-yl)-1-propylazepan-4-ol
CID 114723963
2-(1-benzofuran-2-yl)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol
CID 114724481
4-(1-benzofuran-2-yl)-1,3-dimethylpiperidin-4-ol
CID 23312254
2-[(3R)-3-(1-benzofuran-2-yl)piperidin-3-yl]ethanol
CID 71541292

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol?
The IUPAC name of 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol (CID 114724804) is 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol.
What is the SMILES notation for 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol?
The canonical SMILES for 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol is OC1(c2cc3ccccc3o2)C=CCCC1.
What is the InChIKey of 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol?
The InChIKey is JAHAKCZIIFJVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O2/c15-14(8-4-1-5-9-14)13-10-11-6-2-3-7-12(11)16-13/h2-4,6-8,10,15H,1,5,9H2.
What are the key properties of 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol?
1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol has a molecular weight of 214.26 g/mol, XLogP of 3.36, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)cyclohex-2-en-1-ol is sourced from PubChem (CID 114724804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).