2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol

C10H14N2O2 — CID 168529705

IUPAC2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol
SMILESCOc1cc(C)c(O)c(C=NN)c1C
InChIInChI=1S/C10H14N2O2/c1-6-4-9(14-3)7(2)8(5-12-11)10(6)13/h4-5,13H,11H2,1-3H3
InChIKeyLYUSOIGFOCQFLA-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.31
Rot. Bonds2

About 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol

2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol (PubChem CID 168529705) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol.

Molecular Properties

Compound Name2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol
PubChem CID168529705
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol
SMILESCOc1cc(C)c(O)c(C=NN)c1C
InChIInChI=1S/C10H14N2O2/c1-6-4-9(14-3)7(2)8(5-12-11)10(6)13/h4-5,13H,11H2,1-3H3
InChIKeyLYUSOIGFOCQFLA-UHFFFAOYSA-N
XLogP1.31
TPSA67.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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-methanehydrazonoyl-4-methoxy-6-methylphenol
CID 168529679
(5-bromo-2-methoxy-4-methylphenyl)methylidenehydrazine
CID 168531018
3,5-dimethoxy-2,6-dimethylphenol
CID 25145990
2-bromo-5-methoxy-3,6-dimethylphenol
CID 84694171
2-[2-[(2-hydroxy-5-methoxy-3,6-dimethylphenyl)methylidenehydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl]acetic acid
CID 168620620
2-ethenyl-4-methoxy-6-methyl-3-(methylamino)phenol
CID 165100560
2-methanehydrazonoyl-6-methoxy-4-propan-2-ylphenol
CID 168529675
4-amino-6-methoxy-2,3-dimethylphenol
CID 58463229
2,3-dimethoxy-5,6-dimethylphenol
CID 53405608
2-methoxy-6-methyl-4-nitrosophenol
CID 23270217
3-tert-butyl-4-methoxy-2,6-dimethylphenol
CID 58864792
manganese(2+);2-methanehydrazonoyl-6-methoxyphenol;dichloride
CID 162116939

Frequently Asked Questions

What is the IUPAC name of 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol?
The IUPAC name of 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol (CID 168529705) is 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol.
What is the SMILES notation for 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol?
The canonical SMILES for 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol is COc1cc(C)c(O)c(C=NN)c1C.
What is the InChIKey of 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol?
The InChIKey is LYUSOIGFOCQFLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-6-4-9(14-3)7(2)8(5-12-11)10(6)13/h4-5,13H,11H2,1-3H3.
What are the key properties of 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol?
2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol has a molecular weight of 194.23 g/mol, XLogP of 1.31, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methanehydrazonoyl-4-methoxy-3,6-dimethylphenol is sourced from PubChem (CID 168529705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).