2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol

C15H14O3 — CID 71592841

IUPAC2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol
SMILESCOc1cccc(O)c1/C(O)=C/C=C1C=CC=C1
InChIInChI=1S/C15H14O3/c1-18-14-8-4-7-12(16)15(14)13(17)10-9-11-5-2-3-6-11/h2-10,16-17H,1H3/b13-10-
InChIKeyNEQZXHLDXSYRMA-RAXLEYEMSA-N
MW242.27 g/mol
LogP3.35
Rot. Bonds3

About 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol

2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol (PubChem CID 71592841) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol.

Molecular Properties

Compound Name2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol
PubChem CID71592841
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol
SMILESCOc1cccc(O)c1/C(O)=C/C=C1C=CC=C1
InChIInChI=1S/C15H14O3/c1-18-14-8-4-7-12(16)15(14)13(17)10-9-11-5-2-3-6-11/h2-10,16-17H,1H3/b13-10-
InChIKeyNEQZXHLDXSYRMA-RAXLEYEMSA-N
XLogP3.35
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl)benzene-1,3,5-triol
CID 161072337
cyclopenta-1,3-diene;(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-(2-difluoroboranyloxy-6-methoxyphenyl)prop-1-en-1-olate;iron(2+)
CID 71592751
azane;2-methoxyphenol
CID 172717837
cyclopenta-1,3-diene;(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-(2-hydroxy-4,6-dimethoxyphenyl)prop-1-en-1-olate;iron(2+)
CID 71592851
2-methoxyphenol;molecular bromine
CID 141484212
methanethiol;2-methoxyphenol
CID 141484211
2-methoxyphenol;oxalic acid
CID 162319729
2-hydroxy-6-methoxybenzenecarboximidamide;hydrochloride
CID 171703209
formonitrile;2-methoxyphenol
CID 161059546
2-hydroxy-6-methoxy-N'-methylbenzenecarboximidamide
CID 137209939
2-[(E)-hydroxyiminomethyl]-3-methoxyphenol
CID 135755375
2-[(E)-but-2-en-2-yl]-1,3-dimethoxybenzene
CID 119094700

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol?
The IUPAC name of 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol (CID 71592841) is 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol.
What is the SMILES notation for 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol?
The canonical SMILES for 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol is COc1cccc(O)c1/C(O)=C/C=C1C=CC=C1.
What is the InChIKey of 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol?
The InChIKey is NEQZXHLDXSYRMA-RAXLEYEMSA-N. The full InChI is InChI=1S/C15H14O3/c1-18-14-8-4-7-12(16)15(14)13(17)10-9-11-5-2-3-6-11/h2-10,16-17H,1H3/b13-10-.
What are the key properties of 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol?
2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol has a molecular weight of 242.27 g/mol, XLogP of 3.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-3-cyclopenta-2,4-dien-1-ylidene-1-hydroxyprop-1-enyl]-3-methoxyphenol is sourced from PubChem (CID 71592841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).