3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol

C14H14N2O2 — CID 169381641

IUPAC3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol
SMILESCOc1cc(O)ccc1C=NNc1ccccc1
InChIInChI=1S/C14H14N2O2/c1-18-14-9-13(17)8-7-11(14)10-15-16-12-5-3-2-4-6-12/h2-10,16-17H,1H3
InChIKeyJZMIKWGCMFJDDW-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.85
Rot. Bonds4

About 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol

3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol (PubChem CID 169381641) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol.

Molecular Properties

Compound Name3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol
PubChem CID169381641
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol
SMILESCOc1cc(O)ccc1C=NNc1ccccc1
InChIInChI=1S/C14H14N2O2/c1-18-14-9-13(17)8-7-11(14)10-15-16-12-5-3-2-4-6-12/h2-10,16-17H,1H3
InChIKeyJZMIKWGCMFJDDW-UHFFFAOYSA-N
XLogP2.85
TPSA53.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[3-methoxy-4-[(phenylhydrazinylidene)methyl]phenyl]acetic acid
CID 169384024
4-bromo-2-methoxy-5-[(phenylhydrazinylidene)methyl]phenol
CID 169381526
N-[(2,3,4-trimethoxyphenyl)methylideneamino]aniline
CID 5062184
N-[(4,5-dimethoxy-2-methylphenyl)methylideneamino]aniline
CID 4212050
3,5-dimethoxy-2-[(phenylhydrazinylidene)methyl]phenol
CID 4137951
2-methoxy-6-[(phenylhydrazinylidene)methyl]-4-propan-2-ylphenol
CID 169382296
N-[(E)-(2-bromo-3,4-dimethoxyphenyl)methylideneamino]aniline
CID 110504916
3-[2-[(2,4-dimethoxyphenyl)methylidene]hydrazinyl]benzoic acid
CID 110841501
N-[(E)-(5-bromo-2,3-dimethoxyphenyl)methylideneamino]aniline
CID 110504857
2-methoxy-4-nitro-6-[(E)-(phenylhydrazinylidene)methyl]phenol
CID 136733461
N-[(2,5-dimethoxy-4-nitrophenyl)methylideneamino]aniline
CID 169384053
N-[(2,4,6-trimethoxyphenyl)methylideneamino]aniline
CID 169381531

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol?
The IUPAC name of 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol (CID 169381641) is 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol.
What is the SMILES notation for 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol?
The canonical SMILES for 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol is COc1cc(O)ccc1C=NNc1ccccc1.
What is the InChIKey of 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol?
The InChIKey is JZMIKWGCMFJDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-18-14-9-13(17)8-7-11(14)10-15-16-12-5-3-2-4-6-12/h2-10,16-17H,1H3.
What are the key properties of 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol?
3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol has a molecular weight of 242.28 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-4-[(phenylhydrazinylidene)methyl]phenol is sourced from PubChem (CID 169381641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).