2-cyclopent-2-en-1-yl-4-methoxyphenol

C12H14O2 — CID 12507154

IUPAC2-cyclopent-2-en-1-yl-4-methoxyphenol
SMILESCOc1ccc(O)c(C2C=CCC2)c1
InChIInChI=1S/C12H14O2/c1-14-10-6-7-12(13)11(8-10)9-4-2-3-5-9/h2,4,6-9,13H,3,5H2,1H3
InChIKeyYCQCFWZICJKGAV-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.83
Rot. Bonds2

About 2-cyclopent-2-en-1-yl-4-methoxyphenol

2-cyclopent-2-en-1-yl-4-methoxyphenol (PubChem CID 12507154) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-4-methoxyphenol.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-4-methoxyphenol
PubChem CID12507154
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name2-cyclopent-2-en-1-yl-4-methoxyphenol
SMILESCOc1ccc(O)c(C2C=CCC2)c1
InChIInChI=1S/C12H14O2/c1-14-10-6-7-12(13)11(8-10)9-4-2-3-5-9/h2,4,6-9,13H,3,5H2,1H3
InChIKeyYCQCFWZICJKGAV-UHFFFAOYSA-N
XLogP2.83
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.83
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

2-cyclopent-2-en-1-yl-4-methoxyaniline
CID 13003824
2-[(2S)-azetidin-2-yl]-4-methoxyphenol;hydrochloride
CID 171196735
4-methoxy-2-(oxaziridin-3-yl)phenol
CID 174408639
1-[(1R)-cyclopent-2-en-1-yl]-2-methoxybenzene
CID 2327236
4-methoxy-2-[(2S)-piperidin-2-yl]phenol
CID 131531573
4-methoxy-2-[(2R)-piperidin-2-yl]phenol
CID 131513044
2-[(1S,3S)-3-amino-2,2-dimethylcyclopropyl]-4-methoxyphenol
CID 178197138
(4R)-4-(2-hydroxy-5-methoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171184351
(6R)-6-(2,5-dimethoxyphenyl)-3,6-dihydro-2H-pyran
CID 134928854
1-[(1R)-cyclohex-2-en-1-yl]-4-methoxybenzene
CID 11435403
tert-butyl N-[(2-cyclohex-2-en-1-yl-4-methoxyphenyl)methyl]carbamate
CID 178067096
2-cyclopent-2-en-1-ylbenzene-1,3-diol
CID 130032565

Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-4-methoxyphenol?
The IUPAC name of 2-cyclopent-2-en-1-yl-4-methoxyphenol (CID 12507154) is 2-cyclopent-2-en-1-yl-4-methoxyphenol.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-4-methoxyphenol?
The canonical SMILES for 2-cyclopent-2-en-1-yl-4-methoxyphenol is COc1ccc(O)c(C2C=CCC2)c1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-4-methoxyphenol?
The InChIKey is YCQCFWZICJKGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c1-14-10-6-7-12(13)11(8-10)9-4-2-3-5-9/h2,4,6-9,13H,3,5H2,1H3.
What are the key properties of 2-cyclopent-2-en-1-yl-4-methoxyphenol?
2-cyclopent-2-en-1-yl-4-methoxyphenol has a molecular weight of 190.24 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-4-methoxyphenol is sourced from PubChem (CID 12507154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).