2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol

C20H20N2O2 — CID 136912023

IUPAC2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol
SMILESC=CCc1cccc(/C=N\N=C/c2cccc(CC=C)c2O)c1O
InChIInChI=1S/C20H20N2O2/c1-3-7-15-9-5-11-17(19(15)23)13-21-22-14-18-12-6-10-16(8-4-2)20(18)24/h3-6,9-14,23-24H,1-2,7-8H2/b21-13-,22-14-
InChIKeyUVVAIDOOGMRXEK-JZTLMNBPSA-N
MW320.39 g/mol
LogP4.01
Rot. Bonds7

About 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol

2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol (PubChem CID 136912023) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol.

Molecular Properties

Compound Name2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol
PubChem CID136912023
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol
SMILESC=CCc1cccc(/C=N\N=C/c2cccc(CC=C)c2O)c1O
InChIInChI=1S/C20H20N2O2/c1-3-7-15-9-5-11-17(19(15)23)13-21-22-14-18-12-6-10-16(8-4-2)20(18)24/h3-6,9-14,23-24H,1-2,7-8H2/b21-13-,22-14-
InChIKeyUVVAIDOOGMRXEK-JZTLMNBPSA-N
XLogP4.01
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[[(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol
CID 2279280
1-hydroxy-2-[(2-hydroxy-3-prop-2-enylphenyl)methylideneamino]guanidine
CID 135503417
2-[[(2-hydroxyphenyl)methylhydrazinylidene]methyl]-6-prop-2-enylphenol
CID 137185570
2-hydroxy-N-[(E)-(2-hydroxy-3-prop-2-enylphenyl)methylideneamino]benzamide
CID 135715804
2-[(4-phenylpiperazin-1-yl)iminomethyl]-6-prop-2-enylphenol
CID 727344
N-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylideneamino]naphthalene-1-carboxamide
CID 136663063
1-[(2-hydroxy-3-prop-2-enylphenyl)methylideneamino]-4,4-dimethylpentane-2-thione
CID 152849020
2-[(Z)-[(4-methoxyphenyl)hydrazinylidene]methyl]-6-prop-2-enylphenol
CID 136919154
2-[[[2-hydroxy-3-(2-hydroxypropyl)phenyl]methylidenehydrazinylidene]methyl]-6-(2-hydroxypropyl)phenol
CID 136651800
2-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]-6-prop-2-enylphenol
CID 1361872
N-[(2-hydroxy-3-prop-2-enylphenyl)methylideneamino]-2-methoxybenzamide
CID 5056113
5-bromo-2-hydroxy-N-[(2-hydroxy-3-prop-2-enylphenyl)methylideneamino]benzamide
CID 1120113

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol?
The IUPAC name of 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol (CID 136912023) is 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol.
What is the SMILES notation for 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol?
The canonical SMILES for 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol is C=CCc1cccc(/C=N\N=C/c2cccc(CC=C)c2O)c1O.
What is the InChIKey of 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol?
The InChIKey is UVVAIDOOGMRXEK-JZTLMNBPSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-3-7-15-9-5-11-17(19(15)23)13-21-22-14-18-12-6-10-16(8-4-2)20(18)24/h3-6,9-14,23-24H,1-2,7-8H2/b21-13-,22-14-.
What are the key properties of 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol?
2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol has a molecular weight of 320.39 g/mol, XLogP of 4.01, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-[(Z)-(2-hydroxy-3-prop-2-enylphenyl)methylidenehydrazinylidene]methyl]-6-prop-2-enylphenol is sourced from PubChem (CID 136912023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).