N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide

C15H14N2O3 — CID 78783765

IUPACN-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide
SMILESCO/N=C/c1ccc(C(=O)Nc2cccc(O)c2)cc1
InChIInChI=1S/C15H14N2O3/c1-20-16-10-11-5-7-12(8-6-11)15(19)17-13-3-2-4-14(18)9-13/h2-10,18H,1H3,(H,17,19)/b16-10+
InChIKeyALJDEDCCNGFSQY-MHWRWJLKSA-N
MW270.29 g/mol
LogP2.62
Rot. Bonds4

About N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide

N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide (PubChem CID 78783765) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide
PubChem CID78783765
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC NameN-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide
SMILESCO/N=C/c1ccc(C(=O)Nc2cccc(O)c2)cc1
InChIInChI=1S/C15H14N2O3/c1-20-16-10-11-5-7-12(8-6-11)15(19)17-13-3-2-4-14(18)9-13/h2-10,18H,1H3,(H,17,19)/b16-10+
InChIKeyALJDEDCCNGFSQY-MHWRWJLKSA-N
XLogP2.62
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.62
H-Bond Donors ≤ 52
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

N-(3,4-dimethoxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide
CID 134059556
N-(3,5-dimethoxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide
CID 134059612
4-acetamido-N-(3-hydroxyphenyl)benzamide
CID 110463964
N-[4-[acetyl(methyl)amino]phenyl]-4-(methoxyiminomethyl)benzamide
CID 103598921
4-(dimethylamino)-N-(3-hydroxyphenyl)benzamide
CID 28739881
[4-[[4-[(3-hydroxyphenyl)carbamoyl]phenyl]carbamoyl]phenyl] acetate
CID 3881325
3-(methoxyiminomethyl)benzamide
CID 142643998
4-amino-N-(3-hydroxyphenyl)-3-methylbenzamide
CID 61167676
N-[4-(furan-2-ylmethylcarbamoylamino)phenyl]-4-[(E)-methoxyiminomethyl]benzamide
CID 134050707
4-[(E)-methoxyiminomethyl]-N-(1-methylpyrazol-3-yl)benzamide
CID 134026280
N-(3-hydroxyphenyl)-6-methylpyridine-3-carboxamide
CID 28739709
3-[(3-hydroxybenzoyl)amino]benzamide
CID 103605136

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide?
The IUPAC name of N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide (CID 78783765) is N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide?
The canonical SMILES for N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide is CO/N=C/c1ccc(C(=O)Nc2cccc(O)c2)cc1.
What is the InChIKey of N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide?
The InChIKey is ALJDEDCCNGFSQY-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-20-16-10-11-5-7-12(8-6-11)15(19)17-13-3-2-4-14(18)9-13/h2-10,18H,1H3,(H,17,19)/b16-10+.
What are the key properties of N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide?
N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide has a molecular weight of 270.29 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-4-[(E)-methoxyiminomethyl]benzamide is sourced from PubChem (CID 78783765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).