4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol

C11H16N2O3 — CID 2344023

IUPAC4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol
SMILESCOc1cc(C=NN(C)C)cc(OC)c1O
InChIInChI=1S/C11H16N2O3/c1-13(2)12-7-8-5-9(15-3)11(14)10(6-8)16-4/h5-7,14H,1-4H3
InChIKeyKAEBWINTKXWXBN-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.30
Rot. Bonds4

About 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol

4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol (PubChem CID 2344023) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol.

Molecular Properties

Compound Name4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol
PubChem CID2344023
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol
SMILESCOc1cc(C=NN(C)C)cc(OC)c1O
InChIInChI=1S/C11H16N2O3/c1-13(2)12-7-8-5-9(15-3)11(14)10(6-8)16-4/h5-7,14H,1-4H3
InChIKeyKAEBWINTKXWXBN-UHFFFAOYSA-N
XLogP1.30
TPSA54.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2,6-dimethoxy-4-[(E)-[methyl(phenyl)hydrazinylidene]methyl]phenol
CID 135779670
4-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-2,6-dimethoxyphenol
CID 71361751
2,4-bis[(Z)-(dimethylhydrazinylidene)methyl]-6-ethoxyphenol
CID 135436333
2-[(4-hydroxy-3,5-dimethoxyphenyl)methylideneamino]guanidine
CID 2387812
N-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylideneamino]-N'-[(Z)-(4-hydroxy-3,5-dimethoxyphenyl)methylideneamino]oxamide
CID 135646994
2,6-dimethoxy-4-(naphthalen-2-yliminomethyl)phenol
CID 1284379
N-methyl-N-[(E)-(2,4,5-trimethoxyphenyl)methylideneamino]methanamine
CID 71536298
2-amino-4-(hydroxyiminomethyl)-6-methoxyphenol
CID 171131966
N-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]-N-methylmethanamine
CID 96885458
2-chloro-4-[(E)-(diphenylhydrazinylidene)methyl]-6-methoxyphenol
CID 135755057
2,6-dimethoxy-4-[(E)-(4-methylpiperazin-4-ium-1-yl)iminomethyl]phenol
CID 135852429
N-methyl-N-[(3,4,5-trimethoxyphenyl)methylideneamino]methanethioamide
CID 88523699

Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol?
The IUPAC name of 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol (CID 2344023) is 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol.
What is the SMILES notation for 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol?
The canonical SMILES for 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol is COc1cc(C=NN(C)C)cc(OC)c1O.
What is the InChIKey of 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol?
The InChIKey is KAEBWINTKXWXBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-13(2)12-7-8-5-9(15-3)11(14)10(6-8)16-4/h5-7,14H,1-4H3.
What are the key properties of 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol?
4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol has a molecular weight of 224.26 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylhydrazinylidene)methyl]-2,6-dimethoxyphenol is sourced from PubChem (CID 2344023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).