3-cyclopent-2-en-1-ylphenol

C11H12O — CID 15504268

IUPAC3-cyclopent-2-en-1-ylphenol
SMILESOc1cccc(C2C=CCC2)c1
InChIInChI=1S/C11H12O/c12-11-7-3-6-10(8-11)9-4-1-2-5-9/h1,3-4,6-9,12H,2,5H2
InChIKeyABKIGROMEDKGSG-UHFFFAOYSA-N
MW160.22 g/mol
LogP2.83
Rot. Bonds1

About 3-cyclopent-2-en-1-ylphenol

3-cyclopent-2-en-1-ylphenol (PubChem CID 15504268) has the molecular formula C11H12O and a molecular weight of 160.22 g/mol. Its IUPAC name is 3-cyclopent-2-en-1-ylphenol.

Molecular Properties

Compound Name3-cyclopent-2-en-1-ylphenol
PubChem CID15504268
Molecular FormulaC11H12O
Molecular Weight160.22 g/mol
Exact Mass160.09
IUPAC Name3-cyclopent-2-en-1-ylphenol
SMILESOc1cccc(C2C=CCC2)c1
InChIInChI=1S/C11H12O/c12-11-7-3-6-10(8-11)9-4-1-2-5-9/h1,3-4,6-9,12H,2,5H2
InChIKeyABKIGROMEDKGSG-UHFFFAOYSA-N
XLogP2.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

cyclopenta-1,3-diene;4-cyclopent-2-en-1-yl-2,6-dimethylphenol;2,6-dimethylphenol
CID 158380489
3-cyclohexylphenol
CID 16036
3-cyclopent-2-en-1-ylpyridine
CID 131859585
5-cyclopent-2-en-1-yl-2-benzofuran-1,3-dione
CID 150662580
4-cyclohex-2-en-1-ylphenol
CID 13414842
3-[4-(4-hydroxyphenyl)cyclohexyl]phenol
CID 167227782
1-cyclopent-2-en-1-yl-4-fluorobenzene
CID 12699498
3-[(1S,2R)-2-hydroxycyclohexyl]phenol
CID 54021474
2-chloro-5-cyclopent-2-en-1-ylbenzamide
CID 57422940
3-(2-cyclohex-2-en-1-ylethynyl)phenol
CID 154717764
3-[3-(methylamino)cyclobutyl]phenol
CID 105437059
3-pyrrolidin-3-ylphenol
CID 12937992

Frequently Asked Questions

What is the IUPAC name of 3-cyclopent-2-en-1-ylphenol?
The IUPAC name of 3-cyclopent-2-en-1-ylphenol (CID 15504268) is 3-cyclopent-2-en-1-ylphenol.
What is the SMILES notation for 3-cyclopent-2-en-1-ylphenol?
The canonical SMILES for 3-cyclopent-2-en-1-ylphenol is Oc1cccc(C2C=CCC2)c1.
What is the InChIKey of 3-cyclopent-2-en-1-ylphenol?
The InChIKey is ABKIGROMEDKGSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O/c12-11-7-3-6-10(8-11)9-4-1-2-5-9/h1,3-4,6-9,12H,2,5H2.
What are the key properties of 3-cyclopent-2-en-1-ylphenol?
3-cyclopent-2-en-1-ylphenol has a molecular weight of 160.22 g/mol, XLogP of 2.83, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopent-2-en-1-ylphenol is sourced from PubChem (CID 15504268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).