2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol

C15H15NO3 — CID 136913659

IUPAC2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol
SMILESCOc1cc(/C=N/OCc2ccccc2)ccc1O
InChIInChI=1S/C15H15NO3/c1-18-15-9-13(7-8-14(15)17)10-16-19-11-12-5-3-2-4-6-12/h2-10,17H,11H2,1H3/b16-10+
InChIKeyDLDSLVSRANLQOD-MHWRWJLKSA-N
MW257.29 g/mol
LogP2.95
Rot. Bonds5

About 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol

2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol (PubChem CID 136913659) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol.

Molecular Properties

Compound Name2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol
PubChem CID136913659
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol
SMILESCOc1cc(/C=N/OCc2ccccc2)ccc1O
InChIInChI=1S/C15H15NO3/c1-18-15-9-13(7-8-14(15)17)10-16-19-11-12-5-3-2-4-6-12/h2-10,17H,11H2,1H3/b16-10+
InChIKeyDLDSLVSRANLQOD-MHWRWJLKSA-N
XLogP2.95
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(E)-N-[(4-tert-butylphenyl)methoxy]-1-(4-methoxy-3-phenylmethoxyphenyl)methanimine
CID 6906138
(E)-1-(4-methoxyphenyl)-N-phenylmethoxymethanimine
CID 11499688
4-[[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxymethyl]benzonitrile
CID 2457929
4-[[benzyl(phenyl)hydrazinylidene]methyl]-2-methoxyphenol
CID 4245483
(E)-1-[3,4-bis(phenylmethoxy)phenyl]-N-[(4-methylphenyl)methoxy]methanimine
CID 6905782
(Z)-N-[(2-fluorophenyl)methoxy]-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine
CID 7669404
N-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]-2-phenylmethoxybenzamide
CID 135678576
N-benzyl-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]propanediamide
CID 137063527
2-(benzyliminomethyl)-4-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]phenol
CID 136947963
1-(4-hydroxy-3-methoxyphenyl)-5-phenylpent-1-en-3-one
CID 54335344
4-[(E)-[3-[(E)-[3-[(E)-phenylmethoxyiminomethyl]phenoxy]iminomethyl]phenoxy]iminomethyl]phenol
CID 135462076
(E)-1-(4-hydroxy-3-methoxyphenyl)-5-phenylpent-1-en-3-one
CID 11550934

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol?
The IUPAC name of 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol (CID 136913659) is 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol.
What is the SMILES notation for 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol?
The canonical SMILES for 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol is COc1cc(/C=N/OCc2ccccc2)ccc1O.
What is the InChIKey of 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol?
The InChIKey is DLDSLVSRANLQOD-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H15NO3/c1-18-15-9-13(7-8-14(15)17)10-16-19-11-12-5-3-2-4-6-12/h2-10,17H,11H2,1H3/b16-10+.
What are the key properties of 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol?
2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol has a molecular weight of 257.29 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[(E)-phenylmethoxyiminomethyl]phenol is sourced from PubChem (CID 136913659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).