cyclopent-3-en-1-ol;methanol

C6H12O2 — CID 143818340

IUPACcyclopent-3-en-1-ol;methanol
SMILESCO.OC1CC=CC1
InChIInChI=1S/C5H8O.CH4O/c6-5-3-1-2-4-5;1-2/h1-2,5-6H,3-4H2;2H,1H3
InChIKeyBWCVDZGXHWXCFG-UHFFFAOYSA-N
MW116.16 g/mol
LogP0.31
Rot. Bonds

About cyclopent-3-en-1-ol;methanol

cyclopent-3-en-1-ol;methanol (PubChem CID 143818340) has the molecular formula C6H12O2 and a molecular weight of 116.16 g/mol. Its IUPAC name is cyclopent-3-en-1-ol;methanol.

Molecular Properties

Compound Namecyclopent-3-en-1-ol;methanol
PubChem CID143818340
Molecular FormulaC6H12O2
Molecular Weight116.16 g/mol
Exact Mass116.08
IUPAC Namecyclopent-3-en-1-ol;methanol
SMILESCO.OC1CC=CC1
InChIInChI=1S/C5H8O.CH4O/c6-5-3-1-2-4-5;1-2/h1-2,5-6H,3-4H2;2H,1H3
InChIKeyBWCVDZGXHWXCFG-UHFFFAOYSA-N
XLogP0.31
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclopent-3-en-1-ol;methanol?
The IUPAC name of cyclopent-3-en-1-ol;methanol (CID 143818340) is cyclopent-3-en-1-ol;methanol.
What is the SMILES notation for cyclopent-3-en-1-ol;methanol?
The canonical SMILES for cyclopent-3-en-1-ol;methanol is CO.OC1CC=CC1.
What is the InChIKey of cyclopent-3-en-1-ol;methanol?
The InChIKey is BWCVDZGXHWXCFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O.CH4O/c6-5-3-1-2-4-5;1-2/h1-2,5-6H,3-4H2;2H,1H3.
What are the key properties of cyclopent-3-en-1-ol;methanol?
cyclopent-3-en-1-ol;methanol has a molecular weight of 116.16 g/mol, XLogP of 0.31, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopent-3-en-1-ol;methanol is sourced from PubChem (CID 143818340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).