4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol

C21H19NO3 — CID 135787695

IUPAC4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol
SMILESCOc1ccc(O)c(/C=N/c2ccc(OCc3ccccc3)cc2)c1
InChIInChI=1S/C21H19NO3/c1-24-20-11-12-21(23)17(13-20)14-22-18-7-9-19(10-8-18)25-15-16-5-3-2-4-6-16/h2-14,23H,15H2,1H3/b22-14+
InChIKeyDXFSQBCLQPILQM-HYARGMPZSA-N
MW333.39 g/mol
LogP4.73
Rot. Bonds6

About 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol

4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol (PubChem CID 135787695) has the molecular formula C21H19NO3 and a molecular weight of 333.39 g/mol. Its IUPAC name is 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol.

Molecular Properties

Compound Name4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol
PubChem CID135787695
Molecular FormulaC21H19NO3
Molecular Weight333.39 g/mol
Exact Mass333.14
IUPAC Name4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol
SMILESCOc1ccc(O)c(/C=N/c2ccc(OCc3ccccc3)cc2)c1
InChIInChI=1S/C21H19NO3/c1-24-20-11-12-21(23)17(13-20)14-22-18-7-9-19(10-8-18)25-15-16-5-3-2-4-6-16/h2-14,23H,15H2,1H3/b22-14+
InChIKeyDXFSQBCLQPILQM-HYARGMPZSA-N
XLogP4.73
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol 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

4-methoxy-2-[(4-phenoxyphenyl)iminomethyl]phenol
CID 135681255
[4-[(2-hydroxy-5-methoxyphenyl)methylideneamino]phenyl]-phenylmethanone
CID 177256442
4-[(2-hydroxy-5-methoxyphenyl)methylideneamino]benzonitrile
CID 1040051
2-[(4-chlorophenyl)iminomethyl]-5-phenylmethoxyphenol
CID 139088519
2-[(3-chloro-4-methoxyphenyl)iminomethyl]-4-methoxyphenol
CID 135595566
4-methoxy-2-[(4-piperidin-1-ylphenyl)iminomethyl]phenol
CID 135774295
2-(3H-benzimidazol-5-yliminomethyl)-4-methoxyphenol
CID 137122842
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
1-[3-[(2-hydroxy-5-methoxyphenyl)methylideneamino]phenyl]ethanone
CID 135595395
4-benzyl-2-[(3,4-dimethoxyphenyl)iminomethyl]phenol
CID 135799750
N-[(Z)-(2-hydroxy-5-methoxyphenyl)methylideneamino]-4-[(4-methylphenyl)methoxy]benzamide
CID 136766907
2-[[1-[2-[(2-hydroxy-5-methoxyphenyl)methylideneamino]naphthalen-1-yl]naphthalen-2-yl]iminomethyl]-4-methoxyphenol
CID 136677845

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol?
The IUPAC name of 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol (CID 135787695) is 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol.
What is the SMILES notation for 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol?
The canonical SMILES for 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol is COc1ccc(O)c(/C=N/c2ccc(OCc3ccccc3)cc2)c1.
What is the InChIKey of 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol?
The InChIKey is DXFSQBCLQPILQM-HYARGMPZSA-N. The full InChI is InChI=1S/C21H19NO3/c1-24-20-11-12-21(23)17(13-20)14-22-18-7-9-19(10-8-18)25-15-16-5-3-2-4-6-16/h2-14,23H,15H2,1H3/b22-14+.
What are the key properties of 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol?
4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol has a molecular weight of 333.39 g/mol, XLogP of 4.73, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[(4-phenylmethoxyphenyl)iminomethyl]phenol is sourced from PubChem (CID 135787695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).