4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide

C15H14N2O3 — CID 6862722

IUPAC4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide
SMILESCOc1ccc(/C=N/NC(=O)c2ccc(O)cc2)cc1
InChIInChI=1S/C15H14N2O3/c1-20-14-8-2-11(3-9-14)10-16-17-15(19)12-4-6-13(18)7-5-12/h2-10,18H,1H3,(H,17,19)/b16-10+
InChIKeyMGEOFOSJLBJMGP-MHWRWJLKSA-N
MW270.29 g/mol
LogP2.16
Rot. Bonds4

About 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide

4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide (PubChem CID 6862722) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide
PubChem CID6862722
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide
SMILESCOc1ccc(/C=N/NC(=O)c2ccc(O)cc2)cc1
InChIInChI=1S/C15H14N2O3/c1-20-14-8-2-11(3-9-14)10-16-17-15(19)12-4-6-13(18)7-5-12/h2-10,18H,1H3,(H,17,19)/b16-10+
InChIKeyMGEOFOSJLBJMGP-MHWRWJLKSA-N
XLogP2.16
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 ≤ 52.16
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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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide?
The IUPAC name of 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide (CID 6862722) is 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide.
What is the SMILES notation for 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide?
The canonical SMILES for 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide is COc1ccc(/C=N/NC(=O)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide?
The InChIKey is MGEOFOSJLBJMGP-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-20-14-8-2-11(3-9-14)10-16-17-15(19)12-4-6-13(18)7-5-12/h2-10,18H,1H3,(H,17,19)/b16-10+.
What are the key properties of 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide?
4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide has a molecular weight of 270.29 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide is sourced from PubChem (CID 6862722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).